Phenol, 2- (1, 1-dimethylethyl)-5-methyl-4-nitro-

Modify Date: 2025-08-27 16:07:50

Phenol, 2- (1, 1-dimethylethyl)-5-methyl-4-nitro- Structure
Phenol, 2- (1, 1-dimethylethyl)-5-methyl-4-nitro- structure
Common Name Phenol, 2- (1, 1-dimethylethyl)-5-methyl-4-nitro-
CAS Number 72373-70-7 Molecular Weight 209.24200
Density 1.145g/cm3 Boiling Point 310.5ºC at 760 mmHg
Molecular Formula C11H15NO3 Melting Point N/A
MSDS N/A Flash Point 128.9ºC

 Names

Name 2-tert-butyl-5-methyl-4-nitrophenol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.145g/cm3
Boiling Point 310.5ºC at 760 mmHg
Molecular Formula C11H15NO3
Molecular Weight 209.24200
Flash Point 128.9ºC
Exact Mass 209.10500
PSA 66.05000
LogP 3.42950
Index of Refraction 1.546
InChIKey LCIFJBVMAQCODX-UHFFFAOYSA-N
SMILES Cc1cc(O)c(C(C)(C)C)cc1[N+](=O)[O-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GO7070000
CHEMICAL NAME :
m-Cresol, 6-tert-butyl-4-nitro-
CAS REGISTRY NUMBER :
72373-70-7
BEILSTEIN REFERENCE NO. :
2112620
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H15-N-O3
MOLECULAR WEIGHT :
209.27
WISWESSER LINE NOTATION :
WNR DQ B1 EX1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02514

 Synonyms

m-CRESOL,6-tert-BUTYL-4-NITRO
2-tert-Butyl-5-methyl-4-nitro-phenol
6-Nitro-3-hydroxy-1-methyl-4-tert.-butyl-benzol
6-tert-Butyl-4-nitro-m-cresol
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