Home Halogens 2-[4-(chloromethyl)phenyl]-5-methyl-1,3-benzothiazole

2-[4-(chloromethyl)phenyl]-5-methyl-1,3-benzothiazole

CAS No.:
1095493-96-1
Catalog Number:
AG019U22
Molecular Formula:
C15H12ClNS
Molecular Weight:
273.7805
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Product Description
Catalog Number:
AG019U22
Chemical Name:
2-[4-(chloromethyl)phenyl]-5-methyl-1,3-benzothiazole
CAS Number:
1095493-96-1
Molecular Formula:
C15H12ClNS
Molecular Weight:
273.7805
MDL Number:
MFCD11534882
IUPAC Name:
2-[4-(chloromethyl)phenyl]-5-methyl-1,3-benzothiazole
InChI:
InChI=1S/C15H12ClNS/c1-10-2-7-14-13(8-10)17-15(18-14)12-5-3-11(9-16)4-6-12/h2-8H,9H2,1H3
InChI Key:
YAPJKMGSXVDYII-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1)c1nc2c(s1)ccc(c2)C
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.038g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.778g/mol
Monoisotopic Mass:
273.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties