AG0036FF

84807-26-1 | 4-nitro-2,3-dihydro-1H-indole

AG0036FF

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CAS Number	84807-26-1
Catalog Number	AG0036FF(AGN-PC-00LMHE)
Chemical Name	4-nitro-2,3-dihydro-1H-indole
IUPAC Name	4-nitro-2,3-dihydro-1H-indole
InChI	InChI=1S/C8H8N2O2/c11-10(12)8-3-1-2-7-6(8)4-5-9-7/h1-3,9H,4-5H2
InChI Key	VTQFDUKXUFJCAO-UHFFFAOYSA-N
MDL Number	MFCD07371624
Molecular Formula	C8H8N2O2
Molecular Weight	164.1613
SMILES	[N+](=O)([O-])C1=C2CCNC2=CC=C1
Synonyms	4-Nitroindoline, 84807-26-1, 4-NITRO-2,3-DIHYDRO-1H-INDOLE, 1H-INDOLE,2,3-DIHYDRO-4-NITRO, 2,3-DIHYDRO-4-NITRO-1H-INDOLE, SCHEMBL256723, CTK5F3192, DTXSID80530890, VTQFDUKXUFJCAO-UHFFFAOYSA-N, KS-00000K7S, ZINC8699781, ANW-71671, CN-010, MFCD07371624, AKOS006285329, DS-2638, MB04561, MCULE-9495156161, QC-8236, RP02358, AC-27799, AJ-58276, AK-76999, AN-35792, CJ-13468, SC-12969, DB-076130, ST2411576, TC-160416, 4CH-016345, FT-0694733, Y4212, EN300-80788, A-7584, I10-0703, Q-102594, C8H8N2O2, 4-Nitro-2,3-dihydro-1H-indole 1HCl salt, 4-NITRO-2,3-DIHYDRO-1H-INDOLE HYDROCHLORIDE,

Complexity	190
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.059g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.164g/mol
Monoisotopic Mass	164.059g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	57.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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

Lot Number