Home Halogens 3-(4-chlorophenyl)-3-hydroxy-2-methylpropanenitrile

3-(4-chlorophenyl)-3-hydroxy-2-methylpropanenitrile

CAS No.:
831239-10-2
Catalog Number:
AG01C2I7
Molecular Formula:
C10H10ClNO
Molecular Weight:
195.6455
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Product Description
Catalog Number:
AG01C2I7
Chemical Name:
3-(4-chlorophenyl)-3-hydroxy-2-methylpropanenitrile
CAS Number:
831239-10-2
Molecular Formula:
C10H10ClNO
Molecular Weight:
195.6455
MDL Number:
MFCD21802069
IUPAC Name:
3-(4-chlorophenyl)-3-hydroxy-2-methylpropanenitrile
InChI:
InChI=1S/C10H10ClNO/c1-7(6-12)10(13)8-2-4-9(11)5-3-8/h2-5,7,10,13H,1H3
InChI Key:
SCKJAJFJJUEPSL-UHFFFAOYSA-N
SMILES:
OC(C(C#N)C)c1ccc(cc1)Cl
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.045g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.646g/mol
Monoisotopic Mass:
195.045g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties