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126930-72-1 | Benzene, 1-bromo-4-dodecyl-
CAS No: 126930-72-1 Catalog No: AG000WF2 MDL No:MFCD00191386
Product Description
Catalog Number:
AG000WF2
Chemical Name:
Benzene, 1-bromo-4-dodecyl-
CAS Number:
126930-72-1
Molecular Formula:
C18H29Br
Molecular Weight:
325.3269
MDL Number:
MFCD00191386
IUPAC Name:
1-bromo-4-dodecylbenzene
InChI:
InChI=1S/C18H29Br/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:
RFFMRBISTZHCNY-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1ccc(cc1)Br
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.145g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.334g/mol
Monoisotopic Mass:
324.145g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.6
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