CAS No.911-77-3,N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	911-77-3
Name:	N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride

Formula:	C₁₉H₂₂N₆O₄^.HCl
Molecular Weight:	434.882
Synonyms:	BZ-DL-ARG-P-NA.HCL;Benzamide,N-[4-[(aminoiminomethyl)amino]-1-[[(4-nitrophenyl)amino]carbonyl]butyl]-,monohydrochloride (9CI);Valeranilide, 2-benzamido-5-guanidino-4'-nitro-, monohydrochloride,DL- (8CI);NSC 83264;
EINECS:	213-011-2
Density:	1.37 g/cm³
Melting Point:	~275 °C (dec.)
Appearance:	Light yellow fine crystalline powder
Safety:	22-24/25
PSA:	165.92000
LogP:	4.57520

Synthetic route

: 911-77-3
alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride

A: 125652-40-6
2-Benzoylamino-5-guanidino-pentanoic acid; hydrochloride

B: 100-01-6
4-nitro-aniline

Conditions

Conditions	Yield
With water; papain In tetrahydrofuran var. enzymes;

: 911-77-3
alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride

A: 6453-58-3
N-α-benzoyl-DL-arginine

B: 100-01-6
4-nitro-aniline

Conditions

Conditions	Yield
With water Kinetics; Reagent/catalyst; Temperature; HEPES buffer; Enzymatic reaction;
With water at 37℃; for 0.166667h; pH=8; HEPES buffer; Inert atmosphere; Enzymatic reaction;

: 911-77-3
alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride

: 6453-58-3
N-α-benzoyl-DL-arginine

Conditions

Conditions	Yield
With water In dimethyl sulfoxide at 37℃; pH=7; aq. phosphate buffer; Enzymatic reaction;
With trypsin from bovine pancreas In aq. buffer at 22℃; pH=7.7; Temperature; Microwave irradiation; Enzymatic reaction;

: 911-77-3
alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride

: 100-01-6
4-nitro-aniline

Conditions

Conditions	Yield
With trypsin from bovine pancreas In aq. buffer at 37℃; for 0.166667h; pH=8.2; Kinetics; Concentration; Enzymatic reaction;

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Chemistry

Molecular Formula: C₁₉H₂₃ClN₆O₄
Molar mass: 434.88 g/mol
EINECS: 213-011-2
Melting point: ~275 °C (dec.)
Storage temp: -20°C
Appearance: Light yellow fine crystalline powder
Structure of N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride (911-77-3):

H-Bond Donor: 5
H-Bond Acceptor: 7
Systematic Name: N-(1-Benzamido-4-guanidino-butyl)-4-nitro-benzamide hydrochloride
SMILES: O=[N+]([O-])c2ccc(C(=O)NC(NC(=O)c1ccccc1)CCC/N=C(\N)N)cc2.Cl
InChI: InChI=1/C19H22N6O4.ClH/c20-19(21)22-12-4-7-16(23-17(26)13-5-2-1-3-6-13)24-18(27)14-8-10-15(11-9-14)25(28)29;/h1-3,5-6,8-11,16H,4,7,12H2,(H,23,26)(H,24,27)(H4,20,21,22);1H
InChIKey: DEPWARHMJHIFAY-UHFFFAOYAY
Std. InChI: InChI=1S/C19H22N6O4.ClH/c20-19(21)22-12-4-7-16(23-17(26)13-5-2-1-3-6-13)24-18(27)14-8-10-15(11-9-14)25(28)29;/h1-3,5-6,8-11,16H,4,7,12H2,(H,23,26)(H,24,27)(H4,20,21,22);1H
Std. InChIKey: DEPWARHMJHIFAY-UHFFFAOYSA-N

Toxicity Data With Reference

Carcinogenicity of N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride (911-77-3) hasn't been listed as a carcinogen by NTP, IARC,ACGIH, or CA Prop 65. And its toxicological properties have not been fully investigated.

Safety Profile

Safety Statements:
22: Do not breathe dust
24: Avoid contact with skin
25: Avoid contact with eyes

Specification

N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride (911-77-3) also can be called BANI ; BAPN ; N-alpha-benzoyl-4'-nitro-DL-argininanilide hydrochloride ; Benzamide, N-(4-((aminoiminomethyl)amino)-1-(((4-nitrophenyl)amino)carbonyl)butyl)-, hydrochloride (1:1) . It is hazardous,so the first aid measures and others should be known.Such as: When on the skin: should flush skin with plenty of water immediatelyfor at least 15 minutes while removing contaminated clothing.Or in the eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids.While ,it's Inhaled: Remove from exposure and move to fresh air immediately. Then you have the ingesting of the product : Do not induce vomiting.If victim is conscious and alert, give 2-4 cupfuls of milk or water.
In addition, N-Benzoyl-DL-arginine-4-nitroanilide hydrochloride (911-77-3) can be stable under normal temperature and pressure conditions.It is not compatible with strong oxidizing agents, and you must not take it with incompatible materials.And also prevent it to broken down into hazardous decomposition products: irritating and toxic fumes and gases.