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139477-20-6

139477-20-6 | Carbonic acid, 1,1-dimethylethyl 4-(phenylmethyl)phenyl ester

CAS No: 139477-20-6 Catalog No: AG001B3C MDL No:

Product Description

Catalog Number:
AG001B3C
Chemical Name:
Carbonic acid, 1,1-dimethylethyl 4-(phenylmethyl)phenyl ester
CAS Number:
139477-20-6
Molecular Formula:
C18H20O3
Molecular Weight:
284.3496
IUPAC Name:
(4-benzylphenyl) tert-butyl carbonate
InChI:
InChI=1S/C18H20O3/c1-18(2,3)21-17(19)20-16-11-9-15(10-12-16)13-14-7-5-4-6-8-14/h4-12H,13H2,1-3H3
InChI Key:
QLQKUADFRHXZKI-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Oc1ccc(cc1)Cc1ccccc1

Properties

Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.141g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.355g/mol
Monoisotopic Mass:
284.141g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  

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