Home Halogens 1-chloro-4-[(cyclopentylsulfanyl)methyl]benzene

1-chloro-4-[(cyclopentylsulfanyl)methyl]benzene

CAS No.:
1881331-52-7
Catalog Number:
AG00I2NK
Molecular Formula:
C12H15ClS
Molecular Weight:
226.7655
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$400
- +
5g
98%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG00I2NK
Chemical Name:
1-chloro-4-[(cyclopentylsulfanyl)methyl]benzene
CAS Number:
1881331-52-7
Molecular Formula:
C12H15ClS
Molecular Weight:
226.7655
MDL Number:
MFCD29044112
IUPAC Name:
1-chloro-4-(cyclopentylsulfanylmethyl)benzene
InChI:
InChI=1S/C12H15ClS/c13-11-7-5-10(6-8-11)9-14-12-3-1-2-4-12/h5-8,12H,1-4,9H2
InChI Key:
SINHXMZHGHNMMO-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)CSC1CCCC1
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.762g/mol
Monoisotopic Mass:
226.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties