AG000892

102735-84-2 | 1H-INDAZOLE-3-CARBOXALDEHYDE, 5-CHLORO-

AG000892

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CAS Number	102735-84-2
Catalog Number	AG000892(AGN-PC-0NVG97)
Chemical Name	1H-INDAZOLE-3-CARBOXALDEHYDE, 5-CHLORO-
IUPAC Name	5-chloro-2H-indazole-3-carbaldehyde
InChI	InChI=1S/C8H5ClN2O/c9-5-1-2-7-6(3-5)8(4-12)11-10-7/h1-4H,(H,10,11)
InChI Key	XQELXOTYHCBYAI-UHFFFAOYSA-N
MDL Number	MFCD07781535
Molecular Formula	C8H5ClN2O
Molecular Weight	180.5911
SMILES	ClC1=CC=C2NN=C(C=O)C2=C1
Synonyms	5-chloro-1H-indazole-3-carbaldehyde, 102735-84-2, 5-Chloro indazole-3-carboxaldehyde, 5-chloro-2H-indazole-3-carbaldehyde, 5-Chloroindazole-3-carboxaldehyde, 1H-Indazole-3-carboxaldehyde,5-chloro-, AK111418, 1H-Indazole-3-carboxaldehyde, 5-chloro-, PubChem7807, ACMC-1BUVD, SCHEMBL3541493, CTK4A1436, DTXSID00622089, XQELXOTYHCBYAI-UHFFFAOYSA-N, ZX-RL001845, FCH857313, MFCD07781535, ZINC14984744, AKOS006284428, 5-chloro-2H-indazole-3-carboxaldehyde, AB42684, DS-5220, RP24193, 5-chloranyl-2H-indazole-3-carbaldehyde, AC-15051, AJ-66212, AJ-66213, AN-34323, BC208487, OR305083, QC-11253, SC-91768, AB0098378, AX8103185, AM20120490, FT-0654004, Z2965, Z-6345, 735C842, A800609, I14-4408, J-517227, C8H5ClN2O, ACN-045179, 5-CHLORO-1H-INDAZOLE-3-CARBOXALDEHYDE,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.009g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	180.591g/mol
Monoisotopic Mass	180.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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