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Coronene 95%

CAT: 0286-C25660-03Size: 1000 mgDry Ice: NoHazardous: No
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CAT#:0286-C25660-03Size:1000 mg
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CAS Number
191-07-1
Synonyms
Hexabenzobenzene
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00004134
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.
DOT Name
Not D.O.T.-Regulated
Precautions
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

Coronene

Coronene is a ortho- and peri-fused polycyclic arene that consists of six peri-fused benzene rings.

CAS Number191-07-1
PubChem CID9115
IUPAC Namecoronene
Molecular FormulaC24H12
Molecular Weight300.4
XLogP7.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count24
Formal Charge0
Complexity376
SMILES
C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7
InChI
InChI=1S/C24H12/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19/h1-12H
InChIKey
VPUGDVKSAQVFFS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Coronene
CAS: 191-07-1
CID: 9115
Formula: C24H12
MW: 300.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight300.4
XLogP37.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass300.093900383
Monoisotopic Mass300.093900383
Topological Polar Surface Area0 Ų
Heavy Atom Count24
Formal Charge0
Complexity376
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