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3378-82-3 | 1-Bromo-2-naphthaldehyde
CAS No: 3378-82-3 Catalog No: AG003B16 MDL No:MFCD00046368
Product Description
Catalog Number:
AG003B16
Chemical Name:
1-Bromo-2-naphthaldehyde
CAS Number:
3378-82-3
Molecular Formula:
C11H7BrO
Molecular Weight:
235.0767
MDL Number:
MFCD00046368
IUPAC Name:
1-bromonaphthalene-2-carbaldehyde
InChI:
InChI=1S/C11H7BrO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-7H
InChI Key:
CYGUXEZVBLMVRV-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1Br)cccc2
EC Number:
222-180-1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.968g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.08g/mol
Monoisotopic Mass:
233.968g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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