200,000+ products from a single source!
sales@angenechem.com
133086-86-9 | 1,3,7-Octatriene, 8-bromo-5,6-dichloro-2-(chloromethyl)-, [R*,R*-(E,E)]-(+)- (9CI)
CAS No: 133086-86-9 Catalog No: AG00148P MDL No:
Product Description
Catalog Number:
AG00148P
Chemical Name:
1,3,7-Octatriene, 8-bromo-5,6-dichloro-2-(chloromethyl)-, [R*,R*-(E,E)]-(+)- (9CI)
CAS Number:
133086-86-9
Molecular Formula:
C10H12BrCl3
Molecular Weight:
318.4653
IUPAC Name:
8-bromo-5,6-dichloro-2-(chloromethyl)-6-methylocta-1,3,7-triene
InChI:
InChI=1S/C10H12BrCl3/c1-8(7-12)3-4-9(13)10(2,14)5-6-11/h3-6,9H,1,7H2,2H3
InChI Key:
NJRNUHWBINHZRR-UHFFFAOYSA-N
SMILES:
CC(C(C=CC(=C)CCl)Cl)(C=CBr)Cl
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.919g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.46g/mol
Monoisotopic Mass:
315.919g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
2
XLogP3:
4.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.