Home Halogens 1-chloro-3-methylbutan-2-ol

1-chloro-3-methylbutan-2-ol

CAS No.:
55033-10-8
Catalog Number:
AG01B8JB
Molecular Formula:
C5H11ClO
Molecular Weight:
122.5932
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Product Description
Catalog Number:
AG01B8JB
Chemical Name:
1-chloro-3-methylbutan-2-ol
CAS Number:
55033-10-8
Molecular Formula:
C5H11ClO
Molecular Weight:
122.5932
MDL Number:
MFCD19232155
IUPAC Name:
1-chloro-3-methylbutan-2-ol
InChI:
InChI=1S/C5H11ClO/c1-4(2)5(7)3-6/h4-5,7H,3H2,1-2H3
InChI Key:
OATUOZRGCOGQQF-UHFFFAOYSA-N
SMILES:
ClCC(C(C)C)O
Properties
Complexity:
45.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.05g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
122.592g/mol
Monoisotopic Mass:
122.05g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties