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Home > Encyclopedia > Benzoic acid, 3-[(aminothioxomethyl)amino]-4-methyl- (9CI)

Benzoic acid, 3-[(aminothioxomethyl)amino]-4-methyl- (9CI)

Benzoic acid, 3-[(aminothioxomethyl)amino]-4-methyl- (9CI) structure

Benzoic acid, 3-[(aminothioxomethyl)amino]-4-methyl- (9CI) 

structure
  • CAS No:

    726190-35-8

  • Formula:

    C9H10N2O2S

  • Chemical Name:

    Benzoic acid, 3-[(aminothioxomethyl)amino]-4-methyl- (9CI)

  • Synonyms:

    3-(carbamothioylamino)-4-methylbenzoic acid;726190-35-8;SCHEMBL3523687;BENZOIC ACID, 3-[(AMINOTHIOXOMETHYL)AMINO]-4-METHYL- (9CI);STL553985;ZINC39084086;AKOS027413419;N-(3-carboxy-6-methylphenyl)thiourea;N-(3-carboxy-6-methylphenyl)-thiourea

Benzoic acid, 3-[(aminothioxomethyl)amino]-4-methyl- (9CI) Basic Attributes

210.2529

210.046

Characteristics

107

0.8

Computed Properties

Molecular Weight:210.26
XLogP3:0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:210.04629874
Monoisotopic Mass:210.04629874
Topological Polar Surface Area:107
Heavy Atom Count:14
Complexity:245
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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