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10385-30-5

10385-30-5 | 4-(Benzyloxy);butanoic acid

CAS No: 10385-30-5 Catalog No: AG003KTP MDL No:MFCD01321257

Product Description

Catalog Number:
AG003KTP
Chemical Name:
4-(Benzyloxy);butanoic acid
CAS Number:
10385-30-5
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD01321257
IUPAC Name:
4-phenylmethoxybutanoic acid
InChI:
InChI=1S/C11H14O3/c12-11(13)7-4-8-14-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,12,13)
InChI Key:
CXEFZVVLTJQWBF-UHFFFAOYSA-N
SMILES:
OC(=O)CCCOCc1ccccc1

Properties

Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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