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Details

Stereochemistry ACHIRAL
Molecular Formula C48H24
Molecular Weight 600.7042
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXABENZO(A,D,G,J,M,P)CORONENE

SMILES

C1=CC2=C3C4=CC=CC=C4C5=C6C7=C(C8=CC=CC=C8C9=C7C%10=C(C%11=CC=CC=C%11C(=C2C=C1)C%10=C36)C%12=CC=CC=C9%12)C%13=CC=CC=C5%13

InChI

InChIKey=XHJPOZDMDBETDO-UHFFFAOYSA-N
InChI=1S/C48H24/c1-2-14-26-25(13-1)37-27-15-3-4-16-28(27)39-31-19-7-8-20-32(31)41-34-22-10-12-24-36(34)42-35-23-11-9-21-33(35)40-30-18-6-5-17-29(30)38(26)44-43(37)45(39)47(41)48(42)46(40)44/h1-24H

HIDE SMILES / InChI

Molecular Formula C48H24
Molecular Weight 600.7042
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:29:11 GMT 2023
Edited
by admin
on Sat Dec 16 12:29:11 GMT 2023
Record UNII
7M3LAB7SKL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEXABENZO(A,D,G,J,M,P)CORONENE
Common Name English
1:2,3:4,5:6,7:8,9:10,11:12-Hexabenzocoronene
Common Name English
Code System Code Type Description
PUBCHEM
66107
Created by admin on Sat Dec 16 12:29:11 GMT 2023 , Edited by admin on Sat Dec 16 12:29:11 GMT 2023
PRIMARY
ECHA (EC/EINECS)
213-904-7
Created by admin on Sat Dec 16 12:29:11 GMT 2023 , Edited by admin on Sat Dec 16 12:29:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID50147616
Created by admin on Sat Dec 16 12:29:11 GMT 2023 , Edited by admin on Sat Dec 16 12:29:11 GMT 2023
PRIMARY
WIKIPEDIA
Hexa-cata-hexabenzocoronene
Created by admin on Sat Dec 16 12:29:11 GMT 2023 , Edited by admin on Sat Dec 16 12:29:11 GMT 2023
PRIMARY
FDA UNII
7M3LAB7SKL
Created by admin on Sat Dec 16 12:29:11 GMT 2023 , Edited by admin on Sat Dec 16 12:29:11 GMT 2023
PRIMARY
CAS
1065-80-1
Created by admin on Sat Dec 16 12:29:11 GMT 2023 , Edited by admin on Sat Dec 16 12:29:11 GMT 2023
PRIMARY