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87022-36-4 | 1-(Formamidomethyl)-1H-benzotriazole ,
CAS No: 87022-36-4 Catalog No: AG003D3B MDL No:MFCD00134328
Product Description
Catalog Number:
AG003D3B
Chemical Name:
1-(Formamidomethyl)-1H-benzotriazole ,
CAS Number:
87022-36-4
MDL Number:
MFCD00134328
IUPAC Name:
N-(benzotriazol-1-ylmethyl)formamide
InChI:
InChI=1S/C8H8N4O/c13-6-9-5-12-8-4-2-1-3-7(8)10-11-12/h1-4,6H,5H2,(H,9,13)
InChI Key:
AUDGAMZNNDGYAX-UHFFFAOYSA-N
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.179g/mol
Monoisotopic Mass:
176.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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