AG0024L6

17630-76-1 | 1H-Indole-2,3-dione, 5-chloro-

AG0024L6

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CAS Number	17630-76-1
Catalog Number	AG0024L6(AGN-PC-0JLWMX)
Chemical Name	1H-Indole-2,3-dione, 5-chloro-
EC Number	241-614-0
IUPAC Name	5-chloro-1H-indole-2,3-dione
InChI	InChI=1S/C8H4ClNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3H,(H,10,11,12)
InChI Key	XHDJYQWGFIBCEP-UHFFFAOYSA-N
MDL Number	MFCD00014567
Molecular Formula	C8H4ClNO2
Molecular Weight	181.5759
NSC Number	135811
SMILES	C1=C(Cl)C=CC2=C1C(C(=O)N2)=O
Synonyms	5-Chloroisatin, 17630-76-1, 5-chloroindoline-2,3-dione, 5-Chloro-1H-indole-2,3-dione, 5-chlorisatin, 1H-Indole-2,3-dione, 5-chloro-, 5-chloro-2,3-dihydro-1H-indole-2,3-dione, 5-CHLORO ISATIN, 5-chlor-2,3-dioxoindolin, NSC 135811, MFCD00014567, XHDJYQWGFIBCEP-UHFFFAOYSA-N, 5-chlor-1h-indol-2,3-dion, 2HQ, EINECS 241-614-0, NSC135811, PubChem13607, ACMC-209zyf, 5-Chloroisatin, 97%, AC1Q3MRO, AC1L3D5R, AC1Q3KL5, AC1Q3KL6, Isatin-based compound, 33, 5-chloro-2,3-dioxoindolin, 5-Chloroindolin-2,3-dione, 1H-Indole-2, 5-chloro-, KSC174O1F, SCHEMBL134453, CHEMBL327012, 5-chloro-1H-indol-2,3-dione, BDBM22813, CTK0H4712, KS-00000DIP, TIMTEC-BB SBB003741, DTXSID00170111, 5-chloranyl-1H-indole-2,3-dione, 5-chlorobenzo[d]azoline-2,3-dione, BCP06904, CS-D1123, STR01586, ZINC1722141, 5-Chloro-1H-indole-2,3-dione #, ANW-50869, BBL027809, SBB003741, STK053171, AKOS000200896, AC-5467, AS06263, FS-1030, MCULE-6950215786, NSC-135811, RP24265, RTC-060855, TRA0047389, AC-24972, AJ-31019, AK-28898, AN-10950, BP-12045, BR-28898, CJ-06875, CJ-29251, SC-15632, SY001523, 5-chloro-1H-benzo[d]azolidine-2,3-dione, 1H-Indole-2,3-dione, 5-chloro- (9CI), AB0012061, AB1001218, DB-031776, ST2411963, TC-060855, AM20061085, FT-0620321, FT-0657968, ST50211553, EN300-17212, C-4627, Z-9578, MFCD00014567 (97+%), 630C761, A812172, SR-01000550582, I14-0030, I14-7200, SR-01000550582-1, Z56899110, F0348-3912, InChI=1/C8H4ClNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3H,(H,10,11,12, 176861-97-5, C8H4ClNO2, D03TPH, C8-H4-Cl-N-O2, CID87203, AR-1G7631, 5-Chloroisatin, 98% - 100G 100g, C-5120, 67989-23-5,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.993g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	181.575g/mol
Monoisotopic Mass	180.993g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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