Home Other Building Blocks (3S)-2-methylpentan-3-ol

(3S)-2-methylpentan-3-ol

CAS No.:
70492-65-8
Catalog Number:
AG01DWM5
Molecular Formula:
C6H14O
Molecular Weight:
102.1748
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Product Description
Catalog Number:
AG01DWM5
Chemical Name:
(3S)-2-methylpentan-3-ol
CAS Number:
70492-65-8
Molecular Formula:
C6H14O
Molecular Weight:
102.1748
MDL Number:
MFCD24254314
IUPAC Name:
(3S)-2-methylpentan-3-ol
InChI:
InChI=1S/C6H14O/c1-4-6(7)5(2)3/h5-7H,4H2,1-3H3/t6-/m0/s1
InChI Key:
ISTJMQSHILQAEC-LURJTMIESA-N
SMILES:
CC[C@@H](C(C)C)O
Properties
Complexity:
41.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
102.104g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
102.177g/mol
Monoisotopic Mass:
102.104g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties