Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

2-Azabicyclo[2.2.1]hept-5-en-3-one

Related Products

Hot Products

Name

2-Azabicyclo[2.2.1]hept-5-en-3-one

EINECS 421-830-3
CAS No. 49805-30-3 Density 1.198 g/cm3
PSA 29.10000 LogP 0.38970
Solubility >1000 g/L (23 °C) in water Melting Point 54-58 °C(lit.)
Formula C6H7NO Boiling Point 319.3 °C at 760 mmHg
Molecular Weight 109.128 Flash Point 167.1 °C
Transport Information N/A Appearance solid
Safety 26-36-36/37 Risk Codes 36/37/38-43-22
Molecular Structure Molecular Structure of 49805-30-3 (2-Azabicyclo[2.2.1]hept-5-en-3-one) Hazard Symbols IrritantXi, HarmfulXn
Synonyms

(+/-)-2-Azabicyclo[2.2.1]hept-5-en-3-one;Vince lactam;

Article Data 17

2-Azabicyclo[2.2.1]hept-5-en-3-one Synthetic route

542-92-7

cyclopenta-1,3-diene

506-77-4

cyanogen chloride

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
With sodium hydroxide In methanol at 0 - 5℃; for 8h; pH=4 - 5; Diels-Alder Cycloaddition;95%
19158-51-1

P-toluenesulfonyl cyanide

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
79.3%
19158-51-1

P-toluenesulfonyl cyanide

542-92-7

cyclopenta-1,3-diene

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
With acetic acid In dichloromethane 1) 10 deg C, 3 h, 2) 20 deg C, 1 h;56%
With oxonium Yield given. Multistep reaction;
1189-71-5

isocyanate de chlorosulfonyle

542-92-7

cyclopenta-1,3-diene

A

97911-48-3, 138127-85-2, 146864-12-2, 63838-48-2

(+/-)-6-azabicyclo[3.2.0]hept-3-en-7-one

B

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

C

(+/-)-2,4-diazabicyclo[4.3.0]non-8-ene-3,5-dione

Conditions
ConditionsYield
Stage #1: isocyanate de chlorosulfonyle; cyclopenta-1,3-diene In diethyl ether at -60℃; for 2h;
Stage #2: With potassium hydroxide; sodium sulfite In diethyl ether at 0℃; for 0.5h;
A 46%
B n/a
C n/a
1189-71-5

isocyanate de chlorosulfonyle

542-92-7

cyclopenta-1,3-diene

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
With sodium thiosulfate Yield given;
In dichloromethane at 20℃; for 0.166667h;

3-(Methanesulfonyl)-2-azabicyclo<2.2.1>hepta-2,5-diene

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
With acetic acid In dichloromethane for 1h; Ambient temperature; Yield given;
With acetic acid In dichloromethane for 1h; Mechanism; Ambient temperature;

(1S,4R)-1-(2-Aza-bicyclo[2.2.1]hepta-2,5-diene-3-sulfonylmethyl)-7,7-dimethyl-bicyclo[2.2.1]heptan-2-one

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
With acetic acid Yield given;
49805-27-8

3-tosyl-2-azabicyclo [2.2.1]hepta-2,5-diene

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
With acetic acid
24224-99-5

benzenesulfonyl cyanide

542-92-7

cyclopenta-1,3-diene

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
With l-menthol ethylaluminum dichloride; water 1.) CH2Cl2, -25 deg C, 24 h, 2. ) CH2Cl2; Yield given. Multistep reaction;
542-92-7

cyclopenta-1,3-diene

49805-30-3

2-azabicyclo[2.2.1.]hept-5-en-3-one

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: CH2Cl2 / 2 h / Ambient temperature
2: AcOH / CH2Cl2 / 1 h / Ambient temperature
View Scheme

2-Azabicyclo[2.2.1]hept-5-en-3-one Specification

The Vince Lactam is an organic compound with the formula C6H7NO. The IUPAC name of this chemical is 2-azabicyclo[2.2.1]hept-5-en-3-onato(2-). With the CAS registry number 49805-30-3, it is also named as 4-Amino-2-cyclopentene-1-carboxylic acid lactam. The product's categories are (Intermediate of Abacavir); Heterocycles; Intermediates; Fused Ring Systems; Cyanogen Chloride Derivatives; Hydrocyanic Acid Derivatives. Besides, it should be stored in a closed cool and dry place. It is used as a pharmaceutical intermediate.

Physical properties about Vince Lactam are: (1)ACD/LogP: -1.22; (2)ACD/LogD (pH 5.5): -1.22; (3)ACD/LogD (pH 7.4): -1.22; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.18; (7)ACD/KOC (pH 7.4): 5.18; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Polar Surface Area: 20.31 Å2; (11)Index of Refraction: 1.545; (12)Molar Refractivity: 28.8 cm3; (13)Molar Volume: 91 cm3; (14)Polarizability: 11.41×10-24cm3; (15)Surface Tension: 39.4 dyne/cm; (16)Density: 1.198 g/cm3; (17)Flash Point: 167.1 °C; (18)Enthalpy of Vaporization: 56.09 kJ/mol; (19)Boiling Point: 319.3 °C at 760 mmHg; (20)Vapour Pressure: 0.000342 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed and may cause sensitisation by skin contact. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC2\C=C/C1C2
(2)InChI: InChI=1/C6H7NO/c8-6-4-1-2-5(3-4)7-6/h1-2,4-5H,3H2,(H,7,8)
(3)InChIKey: DDUFYKNOXPZZIW-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C6H7NO/c8-6-4-1-2-5(3-4)7-6/h1-2,4-5H,3H2,(H,7,8)
(5)Std. InChIKey: DDUFYKNOXPZZIW-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 49805-30-3