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1115-20-4 | 3-Hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate
CAS No: 1115-20-4 Catalog No: AG003SYV MDL No:MFCD00059597
Product Description
Catalog Number:
AG003SYV
Chemical Name:
3-Hydroxy-2,2-dimethylpropyl 3-hydroxy-2,2-dimethylpropanoate
CAS Number:
1115-20-4
Molecular Formula:
C10H20O4
Molecular Weight:
204.2634
MDL Number:
MFCD00059597
IUPAC Name:
(3-hydroxy-2,2-dimethylpropyl) 3-hydroxy-2,2-dimethylpropanoate
InChI:
InChI=1S/C10H20O4/c1-9(2,5-11)7-14-8(13)10(3,4)6-12/h11-12H,5-7H2,1-4H3
InChI Key:
SZCWBURCISJFEZ-UHFFFAOYSA-N
SMILES:
OCC(COC(=O)C(CO)(C)C)(C)C
EC Number:
214-222-2
UNII:
CG0A37GAHJ
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.266g/mol
Monoisotopic Mass:
204.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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