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Home > Encyclopedia > Benzoic acid, 2,3-diamino-4-methoxy-, methyl ester (9CI)

Benzoic acid, 2,3-diamino-4-methoxy-, methyl ester (9CI)

Benzoic acid, 2,3-diamino-4-methoxy-, methyl ester (9CI) structure

Benzoic acid, 2,3-diamino-4-methoxy-, methyl ester (9CI) 

structure
  • CAS No:

    201287-70-9

  • Formula:

    C9H12N2O3

  • Chemical Name:

    Benzoic acid, 2,3-diamino-4-methoxy-, methyl ester (9CI)

  • Synonyms:

    Methyl 2,3-diamino-4-methoxybenzoate;SCHEMBL1552911;CTK8H4977;ZINC39084224;Benzoic acid, 2,3-diamino-4-methoxy-, methyl ester

Benzoic acid, 2,3-diamino-4-methoxy-, methyl ester (9CI) Basic Attributes

196.20318

196.085

Characteristics

87.6

0.9

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:196.20
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:196.08479225
Monoisotopic Mass:196.08479225
Topological Polar Surface Area:87.6
Heavy Atom Count:14
Complexity:210
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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