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1373253-11-2 | Methyl 2-cyclopentyl-2-(2-hydroxyphenyl)acetate
CAS No: 1373253-11-2 Catalog No: AG01F9U2 MDL No:
Product Description
Catalog Number:
AG01F9U2
Chemical Name:
Methyl 2-cyclopentyl-2-(2-hydroxyphenyl)acetate
CAS Number:
1373253-11-2
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
IUPAC Name:
methyl 2-cyclopentyl-2-(2-hydroxyphenyl)acetate
InChI:
InChI=1S/C14H18O3/c1-17-14(16)13(10-6-2-3-7-10)11-8-4-5-9-12(11)15/h4-5,8-10,13,15H,2-3,6-7H2,1H3
InChI Key:
FAGDYKOFDODHHZ-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccccc1O)C1CCCC1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.295g/mol
Monoisotopic Mass:
234.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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