Home Other Building Blocks (+)-Isobutyl D-lactate

(+)-Isobutyl D-lactate

CAS No.:
61597-96-4
Catalog Number:
AG003BD0
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
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Product Description
Catalog Number:
AG003BD0
Chemical Name:
(+)-Isobutyl D-lactate
CAS Number:
61597-96-4
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
MDL Number:
MFCD00012307
IUPAC Name:
2-methylpropyl (2R)-2-hydroxypropanoate
InChI:
InChI=1S/C7H14O3/c1-5(2)4-10-7(9)6(3)8/h5-6,8H,4H2,1-3H3/t6-/m1/s1
InChI Key:
WBPAQKQBUKYCJS-ZCFIWIBFSA-N
SMILES:
CC(COC(=O)[C@H](O)C)C
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
146.094g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Synthesis and determination of the absolute configuration of fugomycin and desoxyfugomycin: CD spectroscopy and fungicidal activity of butenolides. Chemistry (Weinheim an der Bergstrasse, Germany) 20040920
Properties