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20419-66-3 | 1H-1,2,3-Triazole-4-carboxamide, 5-amino-1-methyl-
CAS No: 20419-66-3 Catalog No: AG0029B7 MDL No:MFCD06242947
Product Description
Catalog Number:
AG0029B7
Chemical Name:
1H-1,2,3-Triazole-4-carboxamide, 5-amino-1-methyl-
CAS Number:
20419-66-3
Molecular Formula:
C4H7N5O
Molecular Weight:
141.1313
MDL Number:
MFCD06242947
IUPAC Name:
5-amino-1-methyltriazole-4-carboxamide
InChI:
InChI=1S/C4H7N5O/c1-9-3(5)2(4(6)10)7-8-9/h5H2,1H3,(H2,6,10)
InChI Key:
ZJLWYSGGQFFAOS-UHFFFAOYSA-N
SMILES:
NC(=O)c1nnn(c1N)C
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.065g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
141.134g/mol
Monoisotopic Mass:
141.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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