200,000+ products from a single source!
sales@angenechem.com
87969-91-3 | Benzene, chlorodioctyl-
CAS No: 87969-91-3 Catalog No: AG004LYJ MDL No:
Product Description
Catalog Number:
AG004LYJ
Chemical Name:
Benzene, chlorodioctyl-
CAS Number:
87969-91-3
Molecular Formula:
C22H37Cl
Molecular Weight:
336.9822
IUPAC Name:
1-chloro-2,3-dioctylbenzene
InChI:
InChI=1S/C22H37Cl/c1-3-5-7-9-11-13-16-20-17-15-19-22(23)21(20)18-14-12-10-8-6-4-2/h15,17,19H,3-14,16,18H2,1-2H3
InChI Key:
OMNGGFNHTBLWKM-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1c(CCCCCCCC)cccc1Cl
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.258g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.988g/mol
Monoisotopic Mass:
336.258g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.