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137075-28-6

137075-28-6 | Carbonic acid, 4-hydroxybutyl phenyl ester

CAS No: 137075-28-6 Catalog No: AG0012TP MDL No:

Product Description

Catalog Number:
AG0012TP
Chemical Name:
Carbonic acid, 4-hydroxybutyl phenyl ester
CAS Number:
137075-28-6
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
IUPAC Name:
4-hydroxybutyl phenyl carbonate
InChI:
InChI=1S/C11H14O4/c12-8-4-5-9-14-11(13)15-10-6-2-1-3-7-10/h1-3,6-7,12H,4-5,8-9H2
InChI Key:
KVZSCIGTOPVIGR-UHFFFAOYSA-N
SMILES:
OCCCCOC(=O)Oc1ccccc1

Properties

Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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