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15185-59-8 | 3-(3-Bromophenyl);acrylaldehyde
CAS No: 15185-59-8 Catalog No: AG007WTG MDL No:MFCD00996500
Product Description
Catalog Number:
AG007WTG
Chemical Name:
3-(3-Bromophenyl);acrylaldehyde
CAS Number:
15185-59-8
Molecular Formula:
C9H7BrO
Molecular Weight:
211.0553
MDL Number:
MFCD00996500
IUPAC Name:
(E)-3-(3-bromophenyl)prop-2-enal
InChI:
InChI=1S/C9H7BrO/c10-9-5-1-3-8(7-9)4-2-6-11/h1-7H/b4-2+
InChI Key:
QICJGJJHIQBWJR-DUXPYHPUSA-N
SMILES:
O=C/C=C/c1cccc(c1)Br
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
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