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114364-55-5

114364-55-5 | Benzene, 1,2-dibromo-4,5-bis(dodecyloxy)-

CAS No: 114364-55-5 Catalog No: AG000B6M MDL No:

Product Description

Catalog Number:
AG000B6M
Chemical Name:
Benzene, 1,2-dibromo-4,5-bis(dodecyloxy)-
CAS Number:
114364-55-5
Molecular Formula:
C30H52Br2O2
Molecular Weight:
604.5407
IUPAC Name:
1,2-dibromo-4,5-didodecoxybenzene
InChI:
InChI=1S/C30H52Br2O2/c1-3-5-7-9-11-13-15-17-19-21-23-33-29-25-27(31)28(32)26-30(29)34-24-22-20-18-16-14-12-10-8-6-4-2/h25-26H,3-24H2,1-2H3
InChI Key:
YVWBCZNRAMZPOL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOc1cc(Br)c(cc1OCCCCCCCCCCCC)Br

Properties

Complexity:
383  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
604.231g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
604.552g/mol
Monoisotopic Mass:
602.233g/mol
Rotatable Bond Count:
24  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
14.4  

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