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120083-82-1

120083-82-1 | 1H-Indene, 3-(4-chloro-3-methoxyphenyl)-

CAS No: 120083-82-1 Catalog No: AG000Q9F MDL No:

Product Description

Catalog Number:
AG000Q9F
Chemical Name:
1H-Indene, 3-(4-chloro-3-methoxyphenyl)-
CAS Number:
120083-82-1
Molecular Formula:
C16H13ClO
Molecular Weight:
256.7268
IUPAC Name:
3-(4-chloro-3-methoxyphenyl)-1H-indene
InChI:
InChI=1S/C16H13ClO/c1-18-16-10-12(7-9-15(16)17)14-8-6-11-4-2-3-5-13(11)14/h2-5,7-10H,6H2,1H3
InChI Key:
VMDMRVKGRCJKAS-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1Cl)C1=CCc2c1cccc2

Properties

Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.065g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.729g/mol
Monoisotopic Mass:
256.065g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

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