AG00DM3C

51649-35-5 | 2H-Isoindole,4,5,6,7-tetrahydro-(9CI)

AG00DM3C

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CAS Number	51649-35-5
Catalog Number	AG00DM3C(AGN-PC-00G6C1)
Chemical Name	2H-Isoindole,4,5,6,7-tetrahydro-(9CI)
IUPAC Name	4,5,6,7-tetrahydro-2H-isoindole
InChI	InChI=1S/C8H11N/c1-2-4-8-6-9-5-7(8)3-1/h5-6,9H,1-4H2
InChI Key	JSHOAZBZHHEGHI-UHFFFAOYSA-N
MDL Number	MFCD12923767
Molecular Formula	C8H11N
Molecular Weight	121.1796
SMILES	C1CCC2=CNC=C2C1
Synonyms	4,5,6,7-tetrahydro-2H-isoindole, 51649-35-5, SCHEMBL454896, 4,5,6,7-tetrahydroisoindole, DTXSID90472595, 7214AB, ANW-65290, FCH950831, ZINC36436730, AKOS006351287, 2H-Isoindole, 4,5,6,7-tetrahydro-, ACM51649355, AJ-92832, 2H-Isoindole,4,5,6,7-tetrahydro-(9CI), AX8234446, TC-154035, 4,5,6,7-Tetrahydroisoindole,,98.0%(gc), C8H11N, 2H-Isoindole,4,5,6,7-tetrahydro-, CID11788296, 2H-Isoindole, 4,5,6,7-tetrahydro- (9CI),

Complexity	88.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	121.089g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	121.183g/mol
Monoisotopic Mass	121.089g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number