Cas no 29191-53-5 (Benzene, methoxynitro-)

Benzene, methoxynitro- structure
Benzene, methoxynitro- structure
Product Name:Benzene, methoxynitro-
CAS No:29191-53-5
MF:C7H7NO3
MW:153.135381937027
CID:275293
PubChem ID:7048
Update Time:2025-04-19

Benzene, methoxynitro- Chemical and Physical Properties

Names and Identifiers

    • Benzene, methoxynitro-
    • Anisole,ar-nitro- (8CI)
    • ar-Nitroanisole
    • Methoxynitrobenzene
    • Methyl nitrophenyl ether
    • AS-30080
    • 2-Nitroanisole
    • o-Nitro(methoxy)benzene
    • CAS-91-23-6
    • 2-NITROANISOLE [IARC]
    • Tox21_302981
    • Anisole, o-nitro-
    • NCGC00091551-01
    • Benzene, 1-methoxy-2-nitro-
    • ZRE7HLZ17K
    • AKOS000119961
    • N0125
    • MFCD00007096
    • NSC5506
    • Z31131392
    • EINECS 202-052-1
    • O-NITROANISOLE
    • o-Nitrobenzene methyl ether
    • 2-Methoxynitrobenzene
    • 1-Methoxy-2-nitrobenzene
    • UNII-A8BA06542K
    • NSC-5506
    • NCGC00259533-01
    • SMR001372018
    • FT-0613174
    • UNII-ZRE7HLZ17K
    • A8BA06542K
    • NCI-C60388
    • 1-Nitro-2-methoxybenzene
    • NCGC00091551-03
    • NS00002611
    • 2-Nitroanisole, >=99%
    • ortho-Nitrobenzene methyl ether
    • o-Nitroanisol
    • A843769
    • 2-nitro-anisole
    • NCGC00256425-01
    • SCHEMBL186551
    • Q27121353
    • o-Nitrophenyl methyl ether
    • 2-NITROANISOLE [HSDB]
    • NCGC00091551-02
    • 91-23-6
    • MLS002454428
    • NSC 5506
    • Tox21_201984
    • O-NITROANISOLE [MI]
    • HMS3039G04
    • DTXCID70962
    • UN 2730
    • DTXSID3020962
    • SCHEMBL17347343
    • 2-Methoxy-1-nitrobenzene
    • NITROANISOLE, O-
    • AI3-00230
    • CCRIS 2319
    • W-100313
    • CHEMBL166415
    • 1-methoxy-2-nitro-benzene
    • o-methoxynitrobenzene
    • CHEBI:48722
    • EN300-15565
    • 29191-53-5
    • InChI=1/C7H7NO3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H
    • 1-Ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-1-oxido-4-oxo-quinolin-1-ium-3-carboxylic acid
    • HSDB 5186
    • C19270
    • Inchi: 1S/C7H7NO3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3
    • InChI Key: CFBYEGUGFPZCNF-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC=CC=1[N+](=O)[O-]

Computed Properties

  • Exact Mass: 153.04261
  • Monoisotopic Mass: 153.042593
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 143
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.7
  • Topological Polar Surface Area: 55

Experimental Properties

  • Density: 1.222
  • Melting Point: 9.4 DEG C
  • Boiling Point: 277°Cat760mmHg
  • Flash Point: 127°C
  • PSA: 52.37
  • LogP: log Kow = 1.73
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