Home Halogens 2-chlorodibenzo[b,f]oxepine

2-chlorodibenzo[b,f]oxepine

CAS No.:
25558-88-7
Catalog Number:
AG00BF0X
Molecular Formula:
C14H9ClO
Molecular Weight:
228.6737
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Product Description
Catalog Number:
AG00BF0X
Chemical Name:
2-chlorodibenzo[b,f]oxepine
CAS Number:
25558-88-7
Molecular Formula:
C14H9ClO
Molecular Weight:
228.6737
MDL Number:
MFCD22124643
IUPAC Name:
3-chlorobenzo[b][1]benzoxepine
InChI:
InChI=1S/C14H9ClO/c15-12-7-8-14-11(9-12)6-5-10-3-1-2-4-13(10)16-14/h1-9H
InChI Key:
HHDMRCZFEDNRSX-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C=Cc1c(O2)cccc1
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.034g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.675g/mol
Monoisotopic Mass:
228.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties