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1235451-65-6 | BenzenaMine, 5-broMo-2-(2-broMoethoxy)-
CAS No: 1235451-65-6 Catalog No: AG000KRX MDL No:MFCD24038771
Product Description
Catalog Number:
AG000KRX
Chemical Name:
BenzenaMine, 5-broMo-2-(2-broMoethoxy)-
CAS Number:
1235451-65-6
Molecular Formula:
C8H9Br2NO
Molecular Weight:
294.9712
MDL Number:
MFCD24038771
IUPAC Name:
5-bromo-2-(2-bromoethoxy)aniline
InChI:
InChI=1S/C8H9Br2NO/c9-3-4-12-8-2-1-6(10)5-7(8)11/h1-2,5H,3-4,11H2
InChI Key:
PQZCKGRJSMUWTB-UHFFFAOYSA-N
SMILES:
BrCCOc1ccc(cc1N)Br
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.903g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.974g/mol
Monoisotopic Mass:
292.905g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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