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| Name |
m-tert-Butylphenyl methylcarbamate |
EINECS | N/A |
| CAS No. | 780-11-0 | Density | 1.023g/cm3 |
| PSA | 38.33000 | LogP | 3.09320 |
| Solubility | <0.5mg/L(30 oC) | Melting Point |
N/A |
| Formula | C12H17 N O2 | Boiling Point | 275°C at 760 mmHg |
| Molecular Weight | 207.272 | Flash Point | 120.1°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion and skin contact. When heated to decomposition it emits toxic vapors of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Carbamicacid, methyl-, m-tert-butylphenyl ester (6CI,7CI,8CI); Phenol,3-(1,1-dimethylethyl)-, methylcarbamate (9CI); Phenol, m-tert-butyl-,methylcarbamate (6CI); 3-tert-Butylphenyl methylcarbamate; Knockbal; RE 5030;Terbam; m-t-Butylphenyl methylcarbamate; m-tert-Butylphenyl methylcarbamate |
m-tert-Butylphenyl methylcarbamate Chemical Properties
Molecular Structure of m-tert-Butylphenyl methylcarbamate (780-11-0):
EINECS of m-tert-Butylphenyl methylcarbamate (780-11-0): 212-303-7
IUPAC Name: (3-tert-Butylphenyl) N-methylcarbamate
Molecular Formula: C12H17NO2
Molecular Weight: 207.268880 g/mol
XLogP3: 2.9
H-Bond Donor: 1
H-Bond Acceptor: 2
Canonical SMILES: CC(C)(C)C1=CC(=CC=C1)OC(=O)NC
InChI: InChI=1S/C12H17NO2/c1-12(2,3)9-6-5-7-10(8-9)15-11(14)13-4/h5-8H,1-4H3,(H,13,14)
InChIKey: FSJYRLHKLVGCNH-UHFFFAOYSA-N
Index of Refraction: 1.499
Molar Refractivity: 59.57 cm3
Molar Volume: 202.5 cm3
Surface Tension: 32.8 dyne/cm
Density: 1.023 g/cm3
Flash Point: 120.1 °C
Enthalpy of Vaporization: 51.34 kJ/mol
Boiling Point: 275 °C at 760 mmHg
Vapour Pressure: 0.00522 mmHg at 25 °C
Water Solubility: 126.3 mg/L at 25 °C
BRN: 1876800
m-tert-Butylphenyl methylcarbamate Toxicity Data With Reference
| 1. | orl-mus LD50:470 mg/kg | 85ARAE Agricultural Chemicals. 1 (1977),44. | ||
| 2. | skn-mus LD50:2660 mg/kg | JPIFAN Japan Pesticide Information.(4),(1970),28. | ||
| 3. | orl-rbt LD50:505 mg/kg | JPIFAN Japan Pesticide Information.(4),(1970),28. |
m-tert-Butylphenyl methylcarbamate Consensus Reports
Reported in EPA TSCA Inventory.
m-tert-Butylphenyl methylcarbamate Safety Profile
Moderately toxic by ingestion and skin contact. When heated to decomposition it emits toxic vapors of NOx.
m-tert-Butylphenyl methylcarbamate Specification
m-tert-Butylphenyl methylcarbamate (780-11-0) is also called for 3-(1,1-Dimethylethyl)phenol methylcarbamate ; 3-tert-Butylphenyl N-methylcarbamate ; 4-06-00-03295 (Beilstein Handbook Reference) ; H-22 ; Knockbal ; RE 5030 ; TBPMC ; Terbam ; Carbamic acid, methyl-, 3-tert-butylphenyl ester ; Phenol, 3-(1,1-dimethylethyl)-, 1-(N-methylcarbamate) ; Phenol, 3-(1,1-dimethylethyl)-, methylcarbamate .
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