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1004644-57-8 | 3-(3-METHYL-4-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE
CAS No: 1004644-57-8 Catalog No: AG01ANJX MDL No:MFCD03419623
Product Description
Catalog Number:
AG01ANJX
Chemical Name:
3-(3-METHYL-4-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE
CAS Number:
1004644-57-8
Molecular Formula:
C7H11N5O3
Molecular Weight:
213.1939
MDL Number:
MFCD03419623
IUPAC Name:
3-(3-methyl-4-nitropyrazol-1-yl)propanehydrazide
InChI:
InChI=1S/C7H11N5O3/c1-5-6(12(14)15)4-11(10-5)3-2-7(13)9-8/h4H,2-3,8H2,1H3,(H,9,13)
InChI Key:
ZSTIMXOMZSIUMC-UHFFFAOYSA-N
SMILES:
NNC(=O)CCn1nc(c(c1)[N+](=O)[O-])C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.086g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.197g/mol
Monoisotopic Mass:
213.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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