6-Chloro-1H-indazole-3-carbaldehyde - CAS 885521-37-9

Name: 6-Chloro-1H-indazole-3-carbaldehyde
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB038992
Product Name:	6-Chloro-1H-indazole-3-carbaldehyde
CAS:	885521-37-9
Synonyms:	6-chloro-2H-indazole-3-carboxaldehyde; 6-chloro-2H-indazole-3-carbaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	6-chloro-2H-indazole-3-carbaldehyde
Description:	6-Chloro-1H-indazole-3-carbaldehyde (CAS# 885521-37-9) is a useful research chemical.
Molecular Weight:	180.59
Molecular Formula:	C8H5ClN2O
Canonical SMILES:	C1=CC2=C(NN=C2C=C1Cl)C=O
InChI:	InChI=1S/C8H5ClN2O/c9-5-1-2-6-7(3-5)10-11-8(6)4-12/h1-4H,(H,10,11)
InChI Key:	YQELBDVPJNKBAP-UHFFFAOYSA-N
LogP:	2.02880

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]C11H21ClO
Undecanoyl chloride
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2016144704-A2	Heterocyclic autotaxin inhibitor compounds	20150311
ES-2666794-T3	Tricyclic compounds as ligands of the nicotinic acetylcholine alpha-7 receptor	20140613
EP-3083588-A1	Aromatic heterocyclic compounds and their application in pharmaceuticals	20131220
JP-2016540786-A	Aromatic heterocyclic compounds and their application in medicine	20131220
JP-6454346-B2	Aromatic heterocyclic compounds and their application in medicine	20131220

Complexity:	188
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.0090405
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	180.0090405
Rotatable Bond Count:	1
Topological Polar Surface Area:	45.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2