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Home > Aldehydes > 303779-66-0
303779-66-0 | 1-Naphthalenecarboxaldehyde, 3-bromo-
CAS No: 303779-66-0 Catalog No: AG002ZX2 MDL No:
Product Description
Catalog Number:
AG002ZX2
Chemical Name:
1-Naphthalenecarboxaldehyde, 3-bromo-
CAS Number:
303779-66-0
Molecular Formula:
C11H7BrO
Molecular Weight:
235.0767
IUPAC Name:
3-bromonaphthalene-1-carbaldehyde
InChI:
InChI=1S/C11H7BrO/c12-10-5-8-3-1-2-4-11(8)9(6-10)7-13/h1-7H
InChI Key:
VMPJCCFHSYZCJZ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)cc2c1cccc2
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:
2.8
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