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946-80-5

946-80-5 | (Benzyloxy);benzene

CAS No: 946-80-5 Catalog No: AG003O4J MDL No:MFCD00020660

Product Description

Catalog Number:
AG003O4J
Chemical Name:
(Benzyloxy);benzene
CAS Number:
946-80-5
Molecular Formula:
C13H12O
Molecular Weight:
184.2338
MDL Number:
MFCD00020660
IUPAC Name:
phenoxymethylbenzene
InChI:
InChI=1S/C13H12O/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-10H,11H2
InChI Key:
BOTNYLSAWDQNEX-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)OCc1ccccc1
UNII:
BUE863N0L8
NSC Number:
77971

Properties

Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.089g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.238g/mol
Monoisotopic Mass:
184.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

Literature

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