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2-Naphthoyl chloride

CAT: 0926-FN01010-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0926-FN01010-01Size:25 g
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CAS Number
2243-83-6
MDL Number
MFCD00004093
Smiles
C1=CC=C2C=C (C=CC2=C1) C (=O) Cl
Molecular Formula
C11H7ClO
Molecular Weight
190.63 g/mol
Controlled
No

Chemical Information

2-Naphthoyl chloride
CAS Number2243-83-6
PubChem CID75246
IUPAC Namenaphthalene-2-carbonyl chloride
Molecular FormulaC11H7ClO
Molecular Weight190.62
XLogP4.3
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity202
SMILES
C1=CC=C2C=C(C=CC2=C1)C(=O)Cl
InChI
InChI=1S/C11H7ClO/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
InChIKey
XNLBCXGRQWUJLU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Naphthoyl chloride
CAS: 2243-83-6
CID: 75246
Formula: C11H7ClO
MW: 190.62
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight190.62
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass190.0185425
Monoisotopic Mass190.0185425
Topological Polar Surface Area17.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity202
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