AG00109J

132131-24-9 | Benzonitrile, 2-amino-5-iodo-

AG00109J

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CAS Number	132131-24-9
Catalog Number	AG00109J(AGN-PC-0MWFDY)
Chemical Name	Benzonitrile, 2-amino-5-iodo-
IUPAC Name	2-amino-5-iodobenzonitrile
InChI	InChI=1S/C7H5IN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2
InChI Key	PRIOKVMBFXTMRV-UHFFFAOYSA-N
MDL Number	MFCD07787432
Molecular Formula	C7H5IN2
Molecular Weight	244.0325
SMILES	NC1=C(C=C(I)C=C1)C#N
Synonyms	2-Amino-5-iodobenzonitrile, 132131-24-9, Benzonitrile, 2-amino-5-iodo-, 2-amino-5-iodo-benzonitrile, PubChem15845, SCHEMBL1577099, CTK8B7735, DTXSID80433418, PRIOKVMBFXTMRV-UHFFFAOYSA-N, AMX10156, 5937AA, ANW-58318, MFCD07787432, ZINC15443819, AKOS016003095, FCH1323983, QC-8357, TRA0072178, KS-000009V5, AJ-67516, AS-10372, CJ-15147, SY016027, AB0061105, AX8219424, DB-062880, RT-018864, FT-0723724, Z-4353, MFCD07787432 (97+%), J-006127, C7H5IN2, CID9964803,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.95g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	244.035g/mol
Monoisotopic Mass	243.95g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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