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10004-17-8 | 1,3-Dioxolane-2-methanol, 2-methyl-
CAS No: 10004-17-8 Catalog No: AG0000N9 MDL No:MFCD22071617
Product Description
Catalog Number:
AG0000N9
Chemical Name:
1,3-Dioxolane-2-methanol, 2-methyl-
CAS Number:
10004-17-8
Molecular Formula:
C5H10O3
Molecular Weight:
118.1311
MDL Number:
MFCD22071617
IUPAC Name:
(2-methyl-1,3-dioxolan-2-yl)methanol
InChI:
InChI=1S/C5H10O3/c1-5(4-6)7-2-3-8-5/h6H,2-4H2,1H3
InChI Key:
AHQLLEIQWZZXGP-UHFFFAOYSA-N
SMILES:
OCC1(C)OCCO1
Properties
Complexity:
75.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.063g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
118.132g/mol
Monoisotopic Mass:
118.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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