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100127-09-1 | Benzene, [(2-chlorocyclopentyl)thio]-
CAS No: 100127-09-1 Catalog No: AG00010I MDL No:
Product Description
Catalog Number:
AG00010I
Chemical Name:
Benzene, [(2-chlorocyclopentyl)thio]-
CAS Number:
100127-09-1
Molecular Formula:
C11H13ClS
Molecular Weight:
212.7389
IUPAC Name:
(2-chlorocyclopentyl)sulfanylbenzene
InChI:
InChI=1S/C11H13ClS/c12-10-7-4-8-11(10)13-9-5-2-1-3-6-9/h1-3,5-6,10-11H,4,7-8H2
InChI Key:
RHSLVAMGAMGEBE-UHFFFAOYSA-N
SMILES:
ClC1CCCC1Sc1ccccc1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.735g/mol
Monoisotopic Mass:
212.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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