Home Carboxys 2-(1H-pyrazol-1-yl)cyclohexane-1-carboxylic acid hydrochloride

2-(1H-pyrazol-1-yl)cyclohexane-1-carboxylic acid hydrochloride

CAS No.:
1909347-69-8
Catalog Number:
AG01B2CE
Molecular Formula:
C10H15ClN2O2
Molecular Weight:
230.6913
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Product Description
Catalog Number:
AG01B2CE
Chemical Name:
2-(1H-pyrazol-1-yl)cyclohexane-1-carboxylic acid hydrochloride
CAS Number:
1909347-69-8
Molecular Formula:
C10H15ClN2O2
Molecular Weight:
230.6913
MDL Number:
MFCD29907388
IUPAC Name:
2-pyrazol-1-ylcyclohexane-1-carboxylic acid;hydrochloride
InChI:
InChI=1S/C10H14N2O2.ClH/c13-10(14)8-4-1-2-5-9(8)12-7-3-6-11-12;/h3,6-9H,1-2,4-5H2,(H,13,14);1H
InChI Key:
GVSCBBRGLXNCIZ-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCCC1n1cccn1.Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.082g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.692g/mol
Monoisotopic Mass:
230.082g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties