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2,2-Biquinoline

CAT: 0286-B11390-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0286-B11390-01Size:1 g
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CAS Number
119-91-5
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00006740
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

2,2'-Biquinoline

structure in first source

CAS Number119-91-5
PubChem CID8412
IUPAC Name2-quinolin-2-ylquinoline
Molecular FormulaC18H12N2
Molecular Weight256.3
XLogP4.3
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity297
SMILES
C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4C=C3
InChI
InChI=1S/C18H12N2/c1-3-7-15-13(5-1)9-11-17(19-15)18-12-10-14-6-2-4-8-16(14)20-18/h1-12H
InChIKey
WPTCSQBWLUUYDV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2'-Biquinoline
CAS: 119-91-5
CID: 8412
Formula: C18H12N2
MW: 256.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.3
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass256.100048391
Monoisotopic Mass256.100048391
Topological Polar Surface Area25.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity297
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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Alternative Products

CatalogName
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