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76749-37-6

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Basic Information
CAS No.: 76749-37-6
Name: 2-Naphthohydroxamic acid, O-acetate ester
Article Data: 2
Molecular Structure:
Molecular Structure of 76749-37-6 (2-Naphthohydroxamic acid, O-acetate ester)
Formula: C13H11 N O3
Molecular Weight: 229.23
Synonyms: 2-Naphthalenecarboxamide,N-(acetyloxy)- (9CI)
Density: 1.246g/cm3
Boiling Point: 371.13°C (rough estimate)
Safety: Mutation data reported. See also ESTERS and AMINES. When heated to decomposition it emits very toxic fumes of NOx.
PSA: 55.40000
LogP: 2.43860
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Chemistry

IUPAC Name: (Naphthalene-2-carbonylamino) acetate
Synonyms of O-Acetyl-N-(2-naphthoyl)hydroxylamine (CAS NO.76749-37-6): 2-Naphthohydroxamic acid, O-acetate ester ; N-2-Naphthoylhydroxylamine-O-acetate ; Hydroxylamine, O-acetyl-N-(2-naphthoyl)-
InChI: InChI=1/C13H11NO3/c1-9(15)17-14-13(16)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,1H3,(H,14,16) Copy
InChIKey: UDRJIRXNGIDROL-UHFFFAOYAU
Std. InChI: InChI=1S/C13H11NO3/c1-9(15)17-14-13(16)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,1H3,(H,14,16) Copy
Std. InChIKey: UDRJIRXNGIDROL-UHFFFAOYSA-N
CAS NO: 76749-37-6
Molecular Formula: C13H11NO3
Molecular Weight: 229.2313
Molecular Structure :
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 3
Polar Surface Area: 46.61 Å2
Index of Refraction: 1.614
Molar Refractivity: 64.12 cm3
Molar Volume: 183.8 cm3
Surface Tension: 49.9 dyne/cm
Density: 1.246 g/cm3

Toxicity Data With Reference

1.    

mmo-sat 1 µmol/plate

     PAACA3    Proceedings of the American Association for Cancer Research. 21 (1980),126.
2.    

sce-ham:ovr 40 µmol/L/3H-C

     MUREAV    Mutation Research. 88 (1981),81.
3.    

mma-sat 1 µmol/plate

     CBINA8    Chemico-Biological Interactions. 34 (1981),267.

Safety Profile

Mutation data reported. See also ESTERS and AMINES. When O-Acetyl-N-(2-naphthoyl)hydroxylamine (CAS NO.76749-37-6) is heated to decomposition ,it emits very toxic fumes of NOx.