AG002OCE

245-08-9 | 5H-Pyrido[3,2-b]indole

AG002OCE

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CAS Number	245-08-9
Catalog Number	AG002OCE(AGN-PC-0LTM16)
Chemical Name	5H-Pyrido[3,2-b]indole
IUPAC Name	5H-pyrido[3,2-b]indole
InChI	InChI=1S/C11H8N2/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1-7,13H
InChI Key	NSBVOLBUJPCPFH-UHFFFAOYSA-N
MDL Number	MFCD13178683
Molecular Formula	C11H8N2
Molecular Weight	168.1946
SMILES	C1(N2)=CC=CN=C1C3=C2C=CC=C3
Synonyms	5H-Pyrido[3,2-b]indole, delta-Carboline, 245-08-9, 5H-Pyrido(3,2-b)indole, 1h-pyrido[3,2-b]indole, AC1O53AR, CHEMBL175276, SCHEMBL1009117, SCHEMBL15184833, CTK1A6444, DTXSID70179257, ACM245089, MFCD13178683, ZINC28088224, AKOS027322190, FCH1146973, AK312977, P2274, InChI=1/C11H8N2/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1-7,13, ?-Carboline, C11-H8-N2, CID6451402,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.069g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	168.199g/mol
Monoisotopic Mass	168.069g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301
Packing Group	Ⅲ
Precautionary statements	P301+P310
UN Code	UN 2811

Certificate of Analysis

Lot Number