CAS No.127785-96-0,6-Aminomethyl-6,11-dihydro-5H-dibenz[b,e]azepine (E)-2-butenedioate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	127785-96-0
Name:	6-Aminomethyl-6,11-dihydro-5H-dibenz[b,e]azepine (E)-2-butenedioate
Article Data:	3

Formula:	C₁₅H₁₆N₂^.C₄H₄O₄
Molecular Weight:	340.379
Synonyms:	5H-dibenz[b,e]azepine-6-methanamine, 6,11-dihydro-, (2E)-2-butenedioate (1:1);Epinastine Intermediate;1-(6,11-Dihydro-5H-dibenzo[b,e]azepin-6-yl)methanamine (2E)-but-2-enedioate (1:1);6-Amiomethyl-6,11-dihydro-5H-dibenz[b,e]azepin(E)-2-butanedioate(1:1);
EINECS:	685-627-3
Melting Point:	194-195 °C (decomp)
Boiling Point:	616.9 °C at 760 mmHg
Flash Point:	Flash Point: 326.9 °C
PSA:	112.65000
LogP:	3.25280

Synthetic route

: 74860-00-7
N-<(11H-dibenzazepin-6-yl)methyl>phthalimide

: 110-17-8
(2E)-but-2-enedioic acid

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

Conditions

Conditions	Yield
Stage #1: N-<(11H-dibenzazepin-6-yl)methyl>phthalimide With sodium tetrahydroborate In methanol; water; isopropyl alcohol; toluene at 20 - 30℃; for 24.5h; Stage #2: With hydrogenchloride In water; isopropyl alcohol at 20 - 80℃; for 1.5h; Stage #3: (2E)-but-2-enedioic acid With sodium hydroxide Product distribution / selectivity; more than 3 stages;	76.1%
Stage #1: N-<(11H-dibenzazepin-6-yl)methyl>phthalimide With sodium tetrahydroborate In methanol; water; isopropyl alcohol; toluene at 20 - 30℃; for 24.5h; Stage #2: With methanol; sodium hydroxide In water; isopropyl alcohol at 20 - 80℃; for 1.5h; Stage #3: (2E)-but-2-enedioic acid In methanol at 0 - 20℃; for 3h; Product distribution / selectivity;	72.4%
Stage #1: N-<(11H-dibenzazepin-6-yl)methyl>phthalimide With sodium tetrahydroborate In water; isopropyl alcohol at 20 - 30℃; for 24.5h; Stage #2: With acetic acid In water; isopropyl alcohol at 20 - 80℃; for 1.5h; Stage #3: (2E)-but-2-enedioic acid With sodium hydroxide Product distribution / selectivity; more than 3 stages;	69%

: 41218-84-2
6-aminomethyl-6,11-dihydro-5H-dibenzo[b,e]azepine

: 110-17-8
(2E)-but-2-enedioic acid

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

Conditions

Conditions	Yield
In methanol at 20℃; for 1h;	76%
In methanol at 35 - 40℃; for 1.5 - 1.66667h;

: 21535-43-3
N-[2-(phenylmethyl)phenyl]-2-chloroacetamide

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

Conditions

Conditions	Yield
Multi-step reaction with 5 steps 1.1: trichlorophosphate / toluene / 6 h / 65 - 90 °C 2.1: potassium hydroxide / N,N-dimethyl-formamide / 55 °C 2.2: 15 h / 45 °C 3.1: formic acid; hydrogen; 5%-palladium/activated carbon / N,N-dimethyl-formamide / 24 h / 70 °C / 7500.75 Torr 4.1: hydrogenchloride / glycerol; water / 2.5 h / 20 - 110 °C 5.1: methanol / 1 h / 20 °C View Scheme

: 21535-44-4
6-(chloromethyl)-11H-dibenzazepine

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1.1: potassium hydroxide / N,N-dimethyl-formamide / 55 °C 1.2: 15 h / 45 °C 2.1: formic acid; hydrogen; 5%-palladium/activated carbon / N,N-dimethyl-formamide / 24 h / 70 °C / 7500.75 Torr 3.1: hydrogenchloride / glycerol; water / 2.5 h / 20 - 110 °C 4.1: methanol / 1 h / 20 °C View Scheme

: 6-cyclopropylaminomethyl-5H-dibenz(b,e)azepine

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: formic acid; hydrogen; 5%-palladium/activated carbon / N,N-dimethyl-formamide / 24 h / 70 °C / 7500.75 Torr 2: hydrogenchloride / glycerol; water / 2.5 h / 20 - 110 °C 3: methanol / 1 h / 20 °C View Scheme

: 6-cyclopropylaminomethyl-6,11-dihydro-5H-dibenz(b,e)azepine

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: hydrogenchloride / glycerol; water / 2.5 h / 20 - 110 °C 2: methanol / 1 h / 20 °C View Scheme

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

: 40943-37-1
O-methyl-N-(methoxycarbonyl)-isourea

: {imino[N-(5H-dibenz[b,e]azepin-6-yl)methylamino]methyl}carbamate

Conditions

Conditions	Yield
In dimethyl sulfoxide at 40℃; for 22h; Solvent;	94%

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

: 80012-43-7
epinastine

Conditions

Conditions	Yield
With sodium hydroxide In water at 25 - 30℃; for 0.5h;

: N-(iminomethoxymethyl)allylcarbamate

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

: {imino[N-(5H-dibenz[b,e]azepin-6-yl)methylamino]allyl}carbamate

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 50℃; for 21h;

: 127785-96-0
6,11-dihydro-5H-dibenzazepine-6-methanamine fumarate

: 3-amino-9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: dimethyl sulfoxide / 22 h / 40 °C 2: acetic acid / toluene / 23 h / 90 °C View Scheme

Total:67 Page 1 of 2 1 2 Next>>

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Specification

The 6-Aminomethyl-6,11-dihydro-5H-dibenz[b,e]azepine (E)-2-butenedioate with the cas number 127785-96-0 is also called 6-Amiomethyl-6,11-dihydro-5H-dibenz[b,e]azepin(E)-2-butanedioate(1:1). The product type of the 6-Aminomethyl-6,11-dihydro-5H-dibenz[b,e]azepine (E)-2-butenedioate is intermediates.

The properties of the 6-Aminomethyl-6,11-dihydro-5H-dibenz[b,e]azepine (E)-2-butenedioate are: (1)#H bond acceptors: 6; (2)#H bond donors: 5; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 69.67Å²; (5)Flash Point: 326.9 °C; (6)Enthalpy of Vaporization: 96.18 kJ/mol; (7)Boiling Point: 616.9 °C at 760 mmHg; (8)Vapour Pressure: 4.48×10^-16 mmHg at 25°C.

The 6-Aminomethyl-6,11-dihydro-5H-dibenz[b,e]azepine (E)-2-butenedioate can be supplied by the following suppliers: (1)Chongqing Succeway Pharmaceutical Co., Ltd. ; (2)Link Chemicals Co.,Ltd.; (3)Hangzhou Sunny Chemical Co., Ltd.; (4)Nanjing Chemlin Chemical Co., Ltd. ; (5)Yick-Vic Chemicals & Pharmaceuticals (HK) Ltd.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-]C(=O)\C=C\C(=O)O.c1cc3c(cc1)Cc2c(cccc2)C(N3)C[NH3+]
(2)InChI: InChI=1/C15H16N2.C4H4O4/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)17-15;5-3(6)1-2-4(7)8/h1-8,15,17H,9-10,16H2;1-2H,(H,5,6)(H,7,8)/b;2-1+