Cas no 52414-95-6 (1,2,3-Trimethyl-5-nitrobenzene)

1,2,3-Trimethyl-5-nitrobenzene structure
52414-95-6 structure
Product Name:1,2,3-Trimethyl-5-nitrobenzene
CAS No:52414-95-6
MF:C9H11NO2
MW:165.189142465591
CID:385184
PubChem ID:308738
Update Time:2025-04-19

1,2,3-Trimethyl-5-nitrobenzene Chemical and Physical Properties

Names and Identifiers

    • 1,2,3-Trimethyl-5-nitrobenzene
    • Benzene,1,2,3-trimethyl-5-nitro-
    • 1,2,3-TRIMETHYL-5-NITRO-BENZENE
    • AC1L7DJ9
    • ANW-69907
    • CTK8C3283
    • MolPort-003-912-830
    • NSC210784
    • SureCN2105183
    • CS-0453243
    • 3,4,5-Trimethylnitrobenzol
    • A870992
    • AKOS016001797
    • 52414-95-6
    • MFCD00024535
    • 5-Nitro-1,2,3-trimethylbenzene
    • SCHEMBL2105183
    • DTXSID50309015
    • NSC-210784
    • CCA41495
    • AT43792
    • DB-354136
    • MDL： N170781
    • Inchi： 1S/C9H11NO2/c1-6-4-9(10(11)12)5-7(2)8(6)3/h4-5H,1-3H3
    • InChI Key： BEAGEKZOSQKTBW-UHFFFAOYSA-N
    • SMILES： [O-][N+](C1C=C(C)C(C)=C(C)C=1)=O

Computed Properties

  • Exact Mass: 165.07903
  • Monoisotopic Mass: 165.079
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 164
  • 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: 2.8
  • Topological Polar Surface Area: 45.8?2

Experimental Properties

  • Density: 1.1
  • Boiling Point: 285.9°Cat760mmHg
  • Flash Point: 131°C
  • Refractive Index: 1.542
  • PSA: 43.14

1,2,3-Trimethyl-5-nitrobenzene Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A019087715-1g
1,2,3-Trimethyl-5-nitrobenzene
 52414-95-6 95%
1g
 $338.80 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
N170781-25mg
1-NITRO-3,4,5-TRIMETHYLBENZENE
 52414-95-6
25mg
 ￥1,191.00 2021-05-24
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1523910-25mg
1,2,3-Trimethyl-5-nitrobenzene
 52414-95-6 98%
25mg
 ￥1548.00 2024-05-10
Crysdot LLC
CD12065262-1g
1,2,3-Trimethyl-5-nitrobenzene
 52414-95-6 95+%
1g
 $377 2024-07-24
abcr
AB279942-1g
5-Nitro-1,2,3-trimethylbenzene; .
 52414-95-6
1g
 €280.00 2025-04-18

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