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Home > Aldehydes > 832674-05-2
832674-05-2 | 4-(ALLYLOXY)-2-BROMO-5-ETHOXYBENZALDEHYDE
CAS No: 832674-05-2 Catalog No: AG01ANIP MDL No:MFCD02256906
Product Description
Catalog Number:
AG01ANIP
Chemical Name:
4-(ALLYLOXY)-2-BROMO-5-ETHOXYBENZALDEHYDE
CAS Number:
832674-05-2
Molecular Formula:
C12H13BrO3
Molecular Weight:
285.1338
MDL Number:
MFCD02256906
IUPAC Name:
2-bromo-5-ethoxy-4-prop-2-enoxybenzaldehyde
InChI:
InChI=1S/C12H13BrO3/c1-3-5-16-12-7-10(13)9(8-14)6-11(12)15-4-2/h3,6-8H,1,4-5H2,2H3
InChI Key:
WWDBIXQZIMFNSZ-UHFFFAOYSA-N
SMILES:
C=CCOc1cc(Br)c(cc1OCC)C=O
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.005g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.137g/mol
Monoisotopic Mass:
284.005g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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