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CAS Number: 4920-77-8
3-methyl-2-nitrophenol

Structure

3-methyl-2-nitrophenol
Name: 3-methyl-2-nitrophenol
Synonyms:
General Information
Product Number: 4920778

CAS Registry Number 4920-77-8
Name:
Phenol, 3-?methyl-?2-?nitro-
m-Cresol, 2-nitro- (7CI,8CI)
2-Hydroxy-6-methylnitrobenzene
2-Methyl-6-hydroxynitrobenzene
2-Nitro-3-hydroxytoluene
2-Nitro-3-methylphenol

 

Chemical Formula: C7H7NO3
Exact Mass: 153.04
Molecular Weight: 153.14
m/z: 153.04 (100.0%), 154.05 (7.8%)

 

InChI:InChI=1S/C7H7NO3/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4,9H,1H3

InChI Key:QIORDSKCCHRSSD-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C(=CC=C1)O)[N+](=O)[O-]

 

Thermal Properties Value Condition Note
Boiling Point 106-108 °C   (1)SRC
Boiling Point 81 °C Press: 1 Torr (2)CAS
Boiling Point 60-68 °C Press: 9.5 Torr (3)CAS
Enthalpy See full text   (9)CAS
Entropy See full text   (9)CAS
Melting Point 149 °C   (17)CAS

Specification

98%

References
  1. (1) "PhysProp" data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
  2. (2) Sugii, Yoshio; Yakugaku Zasshi 1934, V54, P829-44(in German 149-53) CAPLUS
  3. (3) Riesz, Eugen; Monatshefte fuer Chemie 1928, V50, P335-40 CAPLUS
  4. (9) Mahadevan, D.; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy 2012, V86, P139-151 CAPLUS
  5. (17) Le Guyader, Michel; Compt. Rend. 1965, V261(1(Groupe 8)), P167-9 CAPLUS
  6. (18) Gibson, G. P.; Journal of the Chemical Society, Transactions 1923, V123, P1269-77 CAPLUS
  7. (19) Sasaki, Mitsuru; Bulletin of the Chemical Society of Japan 1977, V50(1), P276-9 CAPLUS
  8. (20) Yin, Wan-Po; ARKIVOC (Gainesville, FL, United States) 2008, (5), P6-16 CAPLUS
  9. (21) Haworth, R. D.; Journal of the Chemical Society, Transactions 1923, V123, P2982-96 CAPLUS
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