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Home > Aldehydes > 138555-58-5
138555-58-5 | 3-(2-Bromophenyl)acrylaldehyde
CAS No: 138555-58-5 Catalog No: AG007ZWR MDL No:MFCD08448692
Product Description
Catalog Number:
AG007ZWR
Chemical Name:
3-(2-Bromophenyl)acrylaldehyde
CAS Number:
138555-58-5
Molecular Formula:
C9H7BrO
Molecular Weight:
211.0553
MDL Number:
MFCD08448692
IUPAC Name:
(E)-3-(2-bromophenyl)prop-2-enal
InChI:
InChI=1S/C9H7BrO/c10-9-6-2-1-4-8(9)5-3-7-11/h1-7H/b5-3+
InChI Key:
NIDKLBQFMCVZKV-HWKANZROSA-N
SMILES:
O=C/C=C/c1ccccc1Br
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
209.968g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.058g/mol
Monoisotopic Mass:
209.968g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Inhibition of chitin synthases and antifungal activities by 2'-benzoyloxycinnamaldehyde from Pleuropterus ciliinervis and its derivatives. | Biological & pharmaceutical bulletin 20070301 |
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