Home Halogens 1H-Inden-1-one, 2-chloro-2,3-dihydro-

1H-Inden-1-one, 2-chloro-2,3-dihydro-

CAS No.:
1579-14-2
Catalog Number:
AG00B24T
Molecular Formula:
C9H7ClO
Molecular Weight:
166.6043
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Product Description
Catalog Number:
AG00B24T
Chemical Name:
1H-Inden-1-one, 2-chloro-2,3-dihydro-
CAS Number:
1579-14-2
Molecular Formula:
C9H7ClO
Molecular Weight:
166.6043
MDL Number:
MFCD01024361
IUPAC Name:
2-chloro-2,3-dihydroinden-1-one
InChI:
InChI=1S/C9H7ClO/c10-8-5-6-3-1-2-4-7(6)9(8)11/h1-4,8H,5H2
InChI Key:
BZGQPEGJOZKLFK-UHFFFAOYSA-N
SMILES:
O=C1C(Cl)Cc2c1cccc2
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.019g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.604g/mol
Monoisotopic Mass:
166.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties