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101693-27-0 | Propanoic acid, 2-(acetyloxy)-, 1,1-diMethylethyl ester, (R)- (9CI)
CAS No: 101693-27-0 Catalog No: AG00058F MDL No:
Product Description
Catalog Number:
AG00058F
Chemical Name:
Propanoic acid, 2-(acetyloxy)-, 1,1-diMethylethyl ester, (R)- (9CI)
CAS Number:
101693-27-0
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
IUPAC Name:
tert-butyl (2R)-2-acetyloxypropanoate
InChI:
InChI=1S/C9H16O4/c1-6(12-7(2)10)8(11)13-9(3,4)5/h6H,1-5H3/t6-/m1/s1
InChI Key:
PHNMHWJIWPTKNO-ZCFIWIBFSA-N
SMILES:
CC(=O)O[C@@H](C(=O)OC(C)(C)C)C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
188.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.223g/mol
Monoisotopic Mass:
188.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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