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1443338-57-5

1443338-57-5 | 2-(4-Chloro-3-ethylphenyl)-3-methyl-butan-2-ol

CAS No: 1443338-57-5 Catalog No: AG01FA4J MDL No:

Product Description

Catalog Number:
AG01FA4J
Chemical Name:
2-(4-Chloro-3-ethylphenyl)-3-methyl-butan-2-ol
CAS Number:
1443338-57-5
Molecular Formula:
C13H19ClO
Molecular Weight:
226.7424
IUPAC Name:
2-(4-chloro-3-ethylphenyl)-3-methylbutan-2-ol
InChI:
InChI=1S/C13H19ClO/c1-5-10-8-11(6-7-12(10)14)13(4,15)9(2)3/h6-9,15H,5H2,1-4H3
InChI Key:
CDADUWYRVQCISU-UHFFFAOYSA-N
SMILES:
CCc1cc(ccc1Cl)C(C(C)C)(O)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:
226.112g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.744g/mol
Monoisotopic Mass:
226.112g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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