Home Halogens 1-Propanethiol, 3-chloro- (8CI,9CI)

1-Propanethiol, 3-chloro- (8CI,9CI)

CAS No.:
17481-19-5
Catalog Number:
AG001ZZ5
Molecular Formula:
C3H7ClS
Molecular Weight:
110.6057
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Product Description
Catalog Number:
AG001ZZ5
Chemical Name:
1-Propanethiol, 3-chloro- (8CI,9CI)
CAS Number:
17481-19-5
Molecular Formula:
C3H7ClS
Molecular Weight:
110.6057
MDL Number:
MFCD00004902
IUPAC Name:
3-chloropropane-1-thiol
InChI:
InChI=1S/C3H7ClS/c4-2-1-3-5/h5H,1-3H2
InChI Key:
TZCFWOHAWRIQGF-UHFFFAOYSA-N
SMILES:
SCCCCl
EC Number:
241-496-0
NSC Number:
64636
Properties
Complexity:
16.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.996g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
110.599g/mol
Monoisotopic Mass:
109.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Molecular photovoltaics in nanoscale dimension. International journal of molecular sciences 20110101
Properties