AG0011TR

13638-82-9 | Pyrene, 1,3,6,8-tetraphenyl-

AG0011TR

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CAS Number	13638-82-9
Catalog Number	AG0011TR(AGN-PC-0JNTQ2)
Chemical Name	Pyrene, 1,3,6,8-tetraphenyl-
IUPAC Name	1,3,6,8-tetraphenylpyrene
InChI	InChI=1S/C40H26/c1-5-13-27(14-6-1)35-25-36(28-15-7-2-8-16-28)32-23-24-34-38(30-19-11-4-12-20-30)26-37(29-17-9-3-10-18-29)33-22-21-31(35)39(32)40(33)34/h1-26H
InChI Key	SIJHJHYRYHIWFW-UHFFFAOYSA-N
MDL Number	MFCD00021662
Molecular Formula	C40H26
Molecular Weight	506.6344
NSC Number	84256
SMILES	c1ccc(cc1)c1cc(c2ccccc2)c2c3c1ccc1c3c(cc2)c(cc1c1ccccc1)c1ccccc1
Synonyms	1,3,6,8-tetraphenylpyrene, 13638-82-9, Pyrene,1,3,6,8-tetraphenyl-, NSC84256, AC1L5VGO, AC1Q1IZB, AC1Q2AQ9, 1,3,6,8-Tetraphenylpyren, CTK4C0287, DTXSID70292632, KS-000017WA, MFCD00021662, NSC-84256, ZINC60096960, AKOS022180905, MCULE-9745226950, AJ-113847, KST-1B0737, AR-1B6388, CID256832, T3042, 15846-26-1,

Complexity	672
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	506.203g/mol
Formal Charge	0
Heavy Atom Count	40
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	506.648g/mol
Monoisotopic Mass	506.203g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	11.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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