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52479-58-0 | NEOPENTYL GLYCOL PROPOXYLATE
CAS No: 52479-58-0 Catalog No: AG00E2IH MDL No:
Product Description
Catalog Number:
AG00E2IH
Chemical Name:
NEOPENTYL GLYCOL PROPOXYLATE
CAS Number:
52479-58-0
IUPAC Name:
3-[3-(3-hydroxypropoxy)-2,2-dimethylpropoxy]propan-1-ol
InChI:
InChI=1S/C11H24O4/c1-11(2,9-14-7-3-5-12)10-15-8-4-6-13/h12-13H,3-10H2,1-2H3
InChI Key:
TXQSSRQPVYENEB-UHFFFAOYSA-N
EC Number:
610-848-9
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.167g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.309g/mol
Monoisotopic Mass:
220.167g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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