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101874-34-4 | Benzene, 1-chloro-4-dodecyl-
CAS No: 101874-34-4 Catalog No: AG0005U3 MDL No:
Product Description
Catalog Number:
AG0005U3
Chemical Name:
Benzene, 1-chloro-4-dodecyl-
CAS Number:
101874-34-4
Molecular Formula:
C18H29Cl
Molecular Weight:
280.8759
IUPAC Name:
1-chloro-4-dodecylbenzene
InChI:
InChI=1S/C18H29Cl/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(19)16-14-17/h13-16H,2-12H2,1H3
InChI Key:
USIYBUYBZOVDPD-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1ccc(cc1)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:
280.196g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.88g/mol
Monoisotopic Mass:
280.196g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.5
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