AG00BZRZ

3274-56-4 | 2,4-Diphenylpyrrole

AG00BZRZ

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CAS Number	3274-56-4
Catalog Number	AG00BZRZ(AGN-PC-0JI5PN)
Chemical Name	2,4-Diphenylpyrrole
IUPAC Name	2,4-diphenyl-1H-pyrrole
InChI	InChI=1S/C16H13N/c1-3-7-13(8-4-1)15-11-16(17-12-15)14-9-5-2-6-10-14/h1-12,17H
InChI Key	FSBPQTRUHOMNPG-UHFFFAOYSA-N
MDL Number	MFCD00958534
Molecular Formula	C16H13N
Molecular Weight	219.2811
NSC Number	116650
SMILES	C1(C2=CC=CC=C2)=CC(C3=CC=CC=C3)=CN1
Synonyms	2,4-Diphenyl-1H-pyrrole, 2,4-Diphenylpyrrole, 3274-56-4, 1H-Pyrrole, 2,4-diphenyl-, Pyrrole, 2,4-diphenyl-, MLS002706666, NSC116650, Pyrrole,4-diphenyl-, AC1L2RLX, AC1Q1IUX, 1H-Pyrrole,4-diphenyl-, 2,4-diphenyl-1H-pyrrol, 1H-Pyrrole,2,4-diphenyl-, SCHEMBL333740, 2,4-Diphenyl-1H-pyrrole #, CHEMBL1707952, CTK4G9219, DTXSID20186411, FSBPQTRUHOMNPG-UHFFFAOYSA-N, ZINC1705899, MFCD00958534, ACM3274564, NSC-116650, AS-37581, SMR001574067, AB0076168, AX8067218, FT-0655598, X-1859, S14-1264, CID76761, AR-1D3822, C16-H13-N, 33567-60-1,

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	219.105g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	219.287g/mol
Monoisotopic Mass	219.105g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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