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262292-02-4 | 1H-Pyrazole-3-carboxylic acid, 5-(1,1-dimethylethyl)-, hydrazide
CAS No: 262292-02-4 Catalog No: AG002SDC MDL No:MFCD00619318
Product Description
Catalog Number:
AG002SDC
Chemical Name:
1H-Pyrazole-3-carboxylic acid, 5-(1,1-dimethylethyl)-, hydrazide
CAS Number:
262292-02-4
Molecular Formula:
C8H14N4O
Molecular Weight:
182.2230
MDL Number:
MFCD00619318
IUPAC Name:
5-tert-butyl-1H-pyrazole-3-carbohydrazide
InChI:
InChI=1S/C8H14N4O/c1-8(2,3)6-4-5(11-12-6)7(13)10-9/h4H,9H2,1-3H3,(H,10,13)(H,11,12)
InChI Key:
ZJFRMJHBYDBUGG-UHFFFAOYSA-N
SMILES:
NNC(=O)c1cc([nH]n1)C(C)(C)C
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.117g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
182.227g/mol
Monoisotopic Mass:
182.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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