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| CAS No.: | 77372-67-9 |
|---|---|
| Name: | 4-n-Butoxyphenylacetohydroxamic acid, O-acetate ester |
| Molecular Structure: | |
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| Formula: | C14H19 N O4 |
| Molecular Weight: | 265.309 |
| Synonyms: | 4-n-Butoxyphenylacetohydroxamic acid, O-acetate ester;[[2-(4-butoxyphenyl)acetyl]amino] acetate |
| Density: | 1.113g/cm3 |
| Boiling Point: | 408.52°C (rough estimate) |
| Safety: | Mutation data reported. See also ESTERS. When heated to decomposition it emits very toxic fumes of NOx. |
| PSA: | 64.63000 |
| LogP: | 2.39320 |
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Chemistry
IUPAC Name: [[2-(4-Butoxyphenyl)acetyl]amino] acetate
Synonyms of O-Acetyl-N-(p-butoxyphenylacetyl)hydroxylamine (CAS NO.77372-67-9): 4-n-Butoxyphenylacetohydroxamic acid, O-acetate ester ; N-4-Butoxyphenylacetylhydroxylamine-O-acetate
InChI: InChI: InChI=1/C14H19NO4/c1-3-4-9-18-13-7-5-12(6-8-13)10-14(17)15-19-11(2)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,17)
InChIKey: CYACPJGPSDSRQT-UHFFFAOYAX
Std. InChI: InChI=1S/C14H19NO4/c1-3-4-9-18-13-7-5-12(6-8-13)10-14(17)15-19-11(2)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,17)
Std. InChIKey: CYACPJGPSDSRQT-UHFFFAOYSA-N
CAS NO: 77372-67-9
Molecular Formula: C14H19NO4
Molecular Weight: 265.305
Molecular Structure : .png)
H bond acceptors: 5
H bond donors: 1
Freely Rotating Bonds: 8
Polar Surface Area: 55.84 Å2
Index of Refraction: 1.508
Molar Refractivity: 71.04 cm3
Molar Volume: 238.2 cm3
Surface Tension: 39.5 dyne/cm
Density: 1.113 g/cm3
Toxicity Data With Reference
| 1. | mmo-sat 1 nmol/plate | PAACA3 Proceedings of the American Association for Cancer Research. 21 (1980),126. | ||
| 2. | sce-ham:ovr 80 µmol/L/3H | MUREAV Mutation Research. 88 (1981),81. |
Safety Profile
Mutation data reported. See also ESTERS. When O-Acetyl-N-(p-butoxyphenylacetyl)hydroxylamine (CAS NO.77372-67-9) is heated to decomposition ,it emits very toxic fumes of NOx.