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28461-49-6 | Benzoic acid, 2-amino-5-methyl-, hydrazide
CAS No: 28461-49-6 Catalog No: AG002VDM MDL No:MFCD00111324
Product Description
Catalog Number:
AG002VDM
Chemical Name:
Benzoic acid, 2-amino-5-methyl-, hydrazide
CAS Number:
28461-49-6
Molecular Formula:
C8H11N3O
Molecular Weight:
165.1924
MDL Number:
MFCD00111324
IUPAC Name:
2-amino-5-methylbenzohydrazide
InChI:
InChI=1S/C8H11N3O/c1-5-2-3-7(9)6(4-5)8(12)11-10/h2-4H,9-10H2,1H3,(H,11,12)
InChI Key:
TYOORXFLYLJSOE-UHFFFAOYSA-N
SMILES:
Cc1cc(C(=O)NN)c(cc1)N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
165.196g/mol
Monoisotopic Mass:
165.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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