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287183-59-9 | 3(2H)-Furanone, 2-(dimethoxymethyl)dihydro-, (2S)-
CAS No: 287183-59-9 Catalog No: AG002W88 MDL No:
Product Description
Catalog Number:
AG002W88
Chemical Name:
3(2H)-Furanone, 2-(dimethoxymethyl)dihydro-, (2S)-
CAS Number:
287183-59-9
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
IUPAC Name:
(2S)-2-(dimethoxymethyl)oxolan-3-one
InChI:
InChI=1S/C7H12O4/c1-9-7(10-2)6-5(8)3-4-11-6/h6-7H,3-4H2,1-2H3/t6-/m1/s1
InChI Key:
ZNGILWZHLQQYOZ-ZCFIWIBFSA-N
SMILES:
COC([C@@H]1OCCC1=O)OC
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
160.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.169g/mol
Monoisotopic Mass:
160.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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