Cas no 78399-78-7 (m-Nitrobenzoic-d4 Acid)

m-Nitrobenzoic-d4 Acid structure
m-Nitrobenzoic-d4 Acid structure
Product Name:m-Nitrobenzoic-d4 Acid
CAS No:78399-78-7
MF:C7H5NO4
MW:171.143548727036
CID:552940
PubChem ID:12200815
Update Time:2025-04-19

m-Nitrobenzoic-d4 Acid Chemical and Physical Properties

Names and Identifiers

    • Benzoic-2,3,4,6-d4acid, 5-nitro- (9CI)
    • 3-NITROBENZOIC-D4 ACID
    • m-Nitrobenzoic-d4 Acid
    • HY-Y1313S
    • 2,3,4,6-Tetradeuterio-5-nitrobenzoic acid
    • 3-Nitrobenzoic acid-d4
    • 78399-78-7
    • D99752
    • SCHEMBL12418888
    • 3-nitro(?H?)benzoic acid
    • CS-0608614
    • Inchi: 1S/C7H5NO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)/i1D,2D,3D,4D
    • InChI Key: AFPHTEQTJZKQAQ-RHQRLBAQSA-N
    • SMILES: OC(C1C([2H])=C([2H])C([2H])=C(C=1[2H])[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 171.04696462g/mol
  • Monoisotopic Mass: 171.04696462g/mol
  • Isotope Atom Count: 4
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 198
  • 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: 1.8
  • Topological Polar Surface Area: 83.1?2

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m-Nitrobenzoic-d4 Acid Suppliers

TAIXING JOXIN BIO-TEC CO.,LTD.
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(CAS:78399-78-7)3-nitrobenzoic-d4 acid
Order Number:JOX-022
Stock Status:in Stock
Quantity:25KG
Purity:98%
Pricing Information Last Updated:Tuesday, 15 July 2025 15:40
Price ($):
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TAIXING JOXIN BIO-TEC CO.,LTD.
(CAS:78399-78-7)3-nitrobenzoic-d4 acid
JOX-022
Purity:98%
Quantity:25KG
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