Home Halogens Benzenemethanol, 4-chloro-a-ethyl-a-methyl-

Benzenemethanol, 4-chloro-a-ethyl-a-methyl-

CAS No.:
3947-53-3
Catalog Number:
AG01AGYR
Molecular Formula:
C10H13ClO
Molecular Weight:
184.6626
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Product Description
Catalog Number:
AG01AGYR
Chemical Name:
Benzenemethanol, 4-chloro-a-ethyl-a-methyl-
CAS Number:
3947-53-3
Molecular Formula:
C10H13ClO
Molecular Weight:
184.6626
MDL Number:
MFCD12068034
IUPAC Name:
2-(4-chlorophenyl)butan-2-ol
InChI:
InChI=1S/C10H13ClO/c1-3-10(2,12)8-4-6-9(11)7-5-8/h4-7,12H,3H2,1-2H3
InChI Key:
IACNUIYMPFGNAN-UHFFFAOYSA-N
SMILES:
CCC(c1ccc(cc1)Cl)(O)C
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.065g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.663g/mol
Monoisotopic Mass:
184.065g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties