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1-Bromo-2-naphthaldehyde

CAT: 0572-TRC-B688455-2.5GSize: 2.5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-B688455-2.5GSize:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3378-82-3
Synonyms
1-Bromo-2-naphthalenecarboxaldehyde
Hazard Statement
No Data Available
Smiles
O=CC1=CC=C2C=CC=CC2=C1Br
Molecular Formula
C11H7BrO
Molecular Weight
235.08
InChI
InChI=1S/C11H7BrO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-7H
Additionnal Information
IUPAC name: 1-bromo-2-naphthaldehyde
Shipping Conditions
Room Temperature

Chemical Information

1-Bromonaphthalene-2-carbaldehyde
CAS Number3378-82-3
PubChem CID76909
IUPAC Name1-bromonaphthalene-2-carbaldehyde
Molecular FormulaC11H7BrO
Molecular Weight235.08
XLogP3.3
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity193
SMILES
C1=CC=C2C(=C1)C=CC(=C2Br)C=O
InChI
InChI=1S/C11H7BrO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-7H
InChIKey
CYGUXEZVBLMVRV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Bromonaphthalene-2-carbaldehyde
CAS: 3378-82-3
CID: 76909
Formula: C11H7BrO
MW: 235.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight235.08
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass233.96803
Monoisotopic Mass233.96803
Topological Polar Surface Area17.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity193
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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