200,000+ products from a single source!
sales@angenechem.com
615534-73-1 | 1-(3-IODOBENZYL)-1H-1,2,4-TRIAZOLE
CAS No: 615534-73-1 Catalog No: AG00EE2K MDL No:MFCD08271930
Product Description
Catalog Number:
AG00EE2K
Chemical Name:
1-(3-IODOBENZYL)-1H-1,2,4-TRIAZOLE
CAS Number:
615534-73-1
Molecular Formula:
C9H8IN3
Molecular Weight:
285.0844
MDL Number:
MFCD08271930
IUPAC Name:
1-[(3-iodophenyl)methyl]-1,2,4-triazole
InChI:
InChI=1S/C9H8IN3/c10-9-3-1-2-8(4-9)5-13-7-11-6-12-13/h1-4,6-7H,5H2
InChI Key:
RFHFJBONYNRFAA-UHFFFAOYSA-N
SMILES:
Ic1cccc(c1)Cn1cncn1
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.976g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.088g/mol
Monoisotopic Mass:
284.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.