Home Halogens Carbamothioic chloride,(3-chlorophenyl)methyl- (9CI)

Carbamothioic chloride,(3-chlorophenyl)methyl- (9CI)

CAS No.:
83508-61-6
Catalog Number:
AG008JA2
Molecular Formula:
C8H7Cl2NS
Molecular Weight:
220.1189
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Product Description
Catalog Number:
AG008JA2
Chemical Name:
Carbamothioic chloride,(3-chlorophenyl)methyl- (9CI)
CAS Number:
83508-61-6
Molecular Formula:
C8H7Cl2NS
Molecular Weight:
220.1189
MDL Number:
MFCD03093838
IUPAC Name:
N-(3-chlorophenyl)-N-methylcarbamothioyl chloride
InChI:
InChI=1S/C8H7Cl2NS/c1-11(8(10)12)7-4-2-3-6(9)5-7/h2-5H,1H3
InChI Key:
JUHCGHAWGWGFIN-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)N(C(=S)Cl)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.968g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.111g/mol
Monoisotopic Mass:
218.968g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties