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Benzo[ghi]perylene

CAT: 0572-TRC-B207700-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-B207700-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
191-24-2
Synonyms
Benzo[ghi]perylene; 1,12-Benzoperylene; 1,12-Benzperylene; NSC 89275
Hazard Statement
Very toxic to aquatic life with long lasting effects; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
c1cc2ccc3ccc4ccc5cccc6c(c1)c2c3c4c56
Molecular Formula
C22 H12
Molecular Weight
276.33
InChI
InChI=1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H
Additionnal Information
IUPAC name: Benzo[g,h,i]perylene
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Benzo(ghi)perylene

Benzo[ghi]perylene is an ortho- and peri-fused polycyclic arene.

CAS Number191-24-2
PubChem CID9117
IUPAC Namehexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene
Molecular FormulaC22H12
Molecular Weight276.3
XLogP6.6
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count22
Formal Charge0
Complexity411
SMILES
C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C(C=C5)C=CC(=C36)C=C2
InChI
InChI=1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H
InChIKey
GYFAGKUZYNFMBN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzo(ghi)perylene
CAS: 191-24-2
CID: 9117
Formula: C22H12
MW: 276.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight276.3
XLogP36.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass276.093900383
Monoisotopic Mass276.093900383
Topological Polar Surface Area0 Ų
Heavy Atom Count22
Formal Charge0
Complexity411
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
003330Benzo[ghi]perylene
S-445Benzo(ghi)perylene - 1ML
REPAH112PAH Std Benzo(ghi)perylene 2000ug/mL in Toluene - 1ML
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REPAH1107PAH Std Benzo(ghi)perylene-d12 200ug/mL in Toluene - 1ML
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FB30435-01Benzo[g, h, i]perylene
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