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76964-27-7 | 1,3-Dioxolane-2-ethanol, 2-ethyl-
CAS No: 76964-27-7 Catalog No: AG0057PB MDL No:
Product Description
Catalog Number:
AG0057PB
Chemical Name:
1,3-Dioxolane-2-ethanol, 2-ethyl-
CAS Number:
76964-27-7
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
IUPAC Name:
2-(2-ethyl-1,3-dioxolan-2-yl)ethanol
InChI:
InChI=1S/C7H14O3/c1-2-7(3-4-8)9-5-6-10-7/h8H,2-6H2,1H3
InChI Key:
AQJAMJORJVLCHJ-UHFFFAOYSA-N
SMILES:
OCCC1(CC)OCCO1
Properties
Complexity:
97
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.094g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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