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183474-64-8 | 3-Pentanone, 1-hydroxy-2-methyl-, (2R)-
CAS No: 183474-64-8 Catalog No: AG0027LA MDL No:
Product Description
Catalog Number:
AG0027LA
Chemical Name:
3-Pentanone, 1-hydroxy-2-methyl-, (2R)-
CAS Number:
183474-64-8
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
IUPAC Name:
(2R)-1-hydroxy-2-methylpentan-3-one
InChI:
InChI=1S/C6H12O2/c1-3-6(8)5(2)4-7/h5,7H,3-4H2,1-2H3/t5-/m1/s1
InChI Key:
JYEMLYGXHDIVRA-RXMQYKEDSA-N
SMILES:
OC[C@H](C(=O)CC)C
Properties
Complexity:
78.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
116.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
116.16g/mol
Monoisotopic Mass:
116.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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