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144526-36-3 | Benzene, 1,4-dibromo-2,5-bis(butoxymethyl)-
CAS No: 144526-36-3 Catalog No: AG001JPD MDL No:
Product Description
Catalog Number:
AG001JPD
Chemical Name:
Benzene, 1,4-dibromo-2,5-bis(butoxymethyl)-
CAS Number:
144526-36-3
Molecular Formula:
C16H24Br2O2
Molecular Weight:
408.1686
IUPAC Name:
1,4-dibromo-2,5-bis(butoxymethyl)benzene
InChI:
InChI=1S/C16H24Br2O2/c1-3-5-7-19-11-13-9-16(18)14(10-15(13)17)12-20-8-6-4-2/h9-10H,3-8,11-12H2,1-2H3
InChI Key:
HMMYBYCUWYTLFA-UHFFFAOYSA-N
SMILES:
CCCCOCc1cc(Br)c(cc1Br)COCCCC
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.012g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
408.174g/mol
Monoisotopic Mass:
406.014g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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