Home Halogens 4-(1-chloroethyl)-1-phenyl-1H-1,2,3-triazole

4-(1-chloroethyl)-1-phenyl-1H-1,2,3-triazole

CAS No.:
1394042-41-1
Catalog Number:
AG019ZZW
Molecular Formula:
C10H10ClN3
Molecular Weight:
207.6595
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Product Description
Catalog Number:
AG019ZZW
Chemical Name:
4-(1-chloroethyl)-1-phenyl-1H-1,2,3-triazole
CAS Number:
1394042-41-1
Molecular Formula:
C10H10ClN3
Molecular Weight:
207.6595
MDL Number:
MFCD22375394
IUPAC Name:
4-(1-chloroethyl)-1-phenyltriazole
InChI:
InChI=1S/C10H10ClN3/c1-8(11)10-7-14(13-12-10)9-5-3-2-4-6-9/h2-8H,1H3
InChI Key:
FCWWQZQKCZWZMS-UHFFFAOYSA-N
SMILES:
CC(c1nnn(c1)c1ccccc1)Cl
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.056g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.661g/mol
Monoisotopic Mass:
207.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties