AG00213L

17564-64-6 | 1H-Isoindole-1,3(2H)-dione, 2-(chloromethyl)-

AG00213L

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CAS Number	17564-64-6
Catalog Number	AG00213L(AGN-PC-00924U)
Chemical Name	1H-Isoindole-1,3(2H)-dione, 2-(chloromethyl)-
EC Number	241-541-4
IUPAC Name	2-(chloromethyl)isoindole-1,3-dione
InChI	InChI=1S/C9H6ClNO2/c10-5-11-8(12)6-3-1-2-4-7(6)9(11)13/h1-4H,5H2
InChI Key	JKGLRGGCGUQNEX-UHFFFAOYSA-N
MDL Number	MFCD00005898
Molecular Formula	C9H6ClNO2
Molecular Weight	195.6024
NSC Number	29558
SMILES	ClCN1C(C2=CC=CC=C2C1=O)=O
UNII	N45CYY145E
Synonyms	17564-64-6, N-(Chloromethyl)phthalimide, 2-(Chloromethyl)isoindoline-1,3-dione, N-Chloromethylphthalimide, Chloromethylphthalimide, N-Chloromethyltrimellitimide, 1H-Isoindole-1,3(2H)-dione, 2-(chloromethyl)-, Phthalimide, N-chloromethyl-, Phthalimide, N-(chloromethyl)-, 2-(Chloromethyl)-1H-isoindole-1,3(2H)-dione, CCRIS 7991, EINECS 241-541-4, MFCD00005898, NSC 29558, 2-(chloromethyl)isoindole-1,3-dione, UNII-N45CYY145E, N45CYY145E, N-CHLOROMETHYL PHTHALIMIDE, JKGLRGGCGUQNEX-UHFFFAOYSA-N, 2-(chloromethyl)-2,3-dihydro-1H-isoindole-1,3-dione, NSC29558, ACMC-209xfs, DSSTox_CID_7790, AC1L3D2C, AC1Q6K2Q, DSSTox_RID_78566, DSSTox_GSID_27790, N-(chloromethyl) phthalimide, SCHEMBL31402, CHEMBL369138, Jsp003599, DTXSID3027790, CTK4D5969, JKGLRGGCGUQNEX-UHFFFAOYSA-, ZINC120051, N-(Chloromethyl)phthalimide, 97%, Tox21_200731, ANW-47606, BBL100147, NSC-29558, SBB000346, STL511907, 1H-Isoindole-1, 2-(chloromethyl)-, AKOS000120605, 2-(Chloromethyl)isoindole-1,3-dione;, MCULE-3711232222, TRA0004639, NCGC00248814-01, NCGC00258285-01, AJ-11653, AM808142, BR-63697, Q271, ZB004058, N-Chloromethylphthalimide[forHPLCLabeling], 2-(chloromethyl)benzo[c]azoline-1,3-dione, CAS-17564-64-6, DB-044228, LS-188474, ST2416188, TR-007992, A5504, FT-0637566, ST50211433, 2-(chloromethyl)benzo[c]azolidine-1,3-dione, KS-00001483, S-5455, 1H-Isoindole-1,3(2H)-dione,2-(chloromethyl)-, 2-(Chloromethyl)-1H-isoindole-1,3(2H)-dione #, 564C646, I10-0673, W-107845, InChI=1/C9H6ClNO2/c10-5-11-8(12)6-3-1-2-4-7(6)9(11)13/h1-4H,5H2, 4-Chloromethylphthalimide, C9H6ClNO2, C9-H6-Cl-N-O2, CID87154, AR-1C8750, N-(Chloromethyl)phthalimide, 97% - 100G 100g, 17869-77-1,

Complexity	230
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.009g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	195.602g/mol
Monoisotopic Mass	195.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H315-H317-H319-H335-H412
Packing Group	Ⅲ
Precautionary statements	P261-P273-P280-P301+P310-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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