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1001755-56-1 | 2-(3-METHYL-4-NITRO-1H-PYRAZOL-1-YL)ACETOHYDRAZIDE
CAS No: 1001755-56-1 Catalog No: AG01ANJS MDL No:MFCD03422951
Product Description
Catalog Number:
AG01ANJS
Chemical Name:
2-(3-METHYL-4-NITRO-1H-PYRAZOL-1-YL)ACETOHYDRAZIDE
CAS Number:
1001755-56-1
Molecular Formula:
C6H9N5O3
Molecular Weight:
199.1674
MDL Number:
MFCD03422951
IUPAC Name:
2-(3-methyl-4-nitropyrazol-1-yl)acetohydrazide
InChI:
InChI=1S/C6H9N5O3/c1-4-5(11(13)14)2-10(9-4)3-6(12)8-7/h2H,3,7H2,1H3,(H,8,12)
InChI Key:
DZFBPXFTTFGKRC-UHFFFAOYSA-N
SMILES:
NNC(=O)Cn1nc(c(c1)[N+](=O)[O-])C
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.071g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.17g/mol
Monoisotopic Mass:
199.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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