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623-61-0 | Isopropyl glycolate
CAS No: 623-61-0 Catalog No: AG003R4Y MDL No:MFCD00046747
Product Description
Catalog Number:
AG003R4Y
Chemical Name:
Isopropyl glycolate
CAS Number:
623-61-0
Molecular Formula:
C5H10O3
Molecular Weight:
118.1311
MDL Number:
MFCD00046747
IUPAC Name:
propan-2-yl 2-hydroxyacetate
InChI:
InChI=1S/C5H10O3/c1-4(2)8-5(7)3-6/h4,6H,3H2,1-2H3
InChI Key:
AZKIQQBSVTWCGY-UHFFFAOYSA-N
SMILES:
OCC(=O)OC(C)C
EC Number:
210-804-5
NSC Number:
14089
Properties
Complexity:
77.7
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:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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