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1622883-44-6 | 1H-Pyrazole-4-carboxylic acid, 1-cyclopropyl-
CAS No: 1622883-44-6 Catalog No: AG001SY5 MDL No:MFCD28405628
Product Description
Catalog Number:
AG001SY5
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 1-cyclopropyl-
CAS Number:
1622883-44-6
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD28405628
IUPAC Name:
1-cyclopropylpyrazole-4-carboxylic acid
InChI:
InChI=1S/C7H8N2O2/c10-7(11)5-3-8-9(4-5)6-1-2-6/h3-4,6H,1-2H2,(H,10,11)
InChI Key:
AUPHADTZIOYAMZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnn(c1)C1CC1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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