200,000+ products from a single source!
sales@angenechem.com
133100-87-5 | Isoquinoline, 4-bromo-3-methyl-
CAS No: 133100-87-5 Catalog No: AG00149T MDL No:MFCD05981996
Product Description
Catalog Number:
AG00149T
Chemical Name:
Isoquinoline, 4-bromo-3-methyl-
CAS Number:
133100-87-5
Molecular Formula:
C10H8BrN
Molecular Weight:
222.0812
MDL Number:
MFCD05981996
IUPAC Name:
4-bromo-3-methylisoquinoline
InChI:
InChI=1S/C10H8BrN/c1-7-10(11)9-5-3-2-4-8(9)6-12-7/h2-6H,1H3
InChI Key:
GAGBZCVLKGZXFY-UHFFFAOYSA-N
SMILES:
Cc1ncc2c(c1Br)cccc2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.984g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.085g/mol
Monoisotopic Mass:
220.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.