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114191-56-9 | 1-Naphthaleneacetic acid, 2-hydroxyethyl ester
CAS No: 114191-56-9 Catalog No: AG000ARC MDL No:
Product Description
Catalog Number:
AG000ARC
Chemical Name:
1-Naphthaleneacetic acid, 2-hydroxyethyl ester
CAS Number:
114191-56-9
Molecular Formula:
C14H14O3
Molecular Weight:
230.2592
IUPAC Name:
2-hydroxyethyl 2-naphthalen-1-ylacetate
InChI:
InChI=1S/C14H14O3/c15-8-9-17-14(16)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-7,15H,8-10H2
InChI Key:
ZKXRDGIXVWBCQY-UHFFFAOYSA-N
SMILES:
OCCOC(=O)Cc1cccc2c1cccc2
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.094g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.263g/mol
Monoisotopic Mass:
230.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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