Home Other Building Blocks 2-(1-HYDROXYCYCLOHEXYL)-2-METHYLPROPANENITRILE

2-(1-HYDROXYCYCLOHEXYL)-2-METHYLPROPANENITRILE

CAS No.:
7178-96-3
Catalog Number:
AG01DWMJ
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
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Product Description
Catalog Number:
AG01DWMJ
Chemical Name:
2-(1-HYDROXYCYCLOHEXYL)-2-METHYLPROPANENITRILE
CAS Number:
7178-96-3
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
MDL Number:
MFCD21801339
IUPAC Name:
2-(1-hydroxycyclohexyl)-2-methylpropanenitrile
InChI:
InChI=1S/C10H17NO/c1-9(2,8-11)10(12)6-4-3-5-7-10/h12H,3-7H2,1-2H3
InChI Key:
CAPFEGFDDNRVFW-UHFFFAOYSA-N
SMILES:
N#CC(C1(O)CCCCC1)(C)C
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties