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7-Chloro-1H-pyrazolo[3,4-c]pyridine

7-Chloro-1H-pyrazolo[3,4-c]pyridine - CAS 76006-11-6

Name: 7-Chloro-1H-pyrazolo[3,4-c]pyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB035469
Product Name:	7-Chloro-1H-pyrazolo[3,4-c]pyridine
CAS:	76006-11-6
Synonyms:	7-chloro-1H-pyrazolo[3,4-c]pyridine; 7-chloro-1H-pyrazolo[3,4-c]pyridine

Technical Data

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Computed Properties

IUPAC Name:	7-chloro-1H-pyrazolo[3,4-c]pyridine
Description:	7-Chloro-1H-pyrazolo[3,4-c]pyridine (CAS# 76006-11-6) is a useful research chemical.
Molecular Weight:	153.57
Molecular Formula:	C6H4ClN3
Canonical SMILES:	C1=CN=C(C2=C1C=NN2)Cl
InChI:	InChI=1S/C6H4ClN3/c7-6-5-4(1-2-8-6)3-9-10-5/h1-3H,(H,9,10)
InChI Key:	LGYXPMDWRGMZCV-UHFFFAOYSA-N
Boiling Point:	357.485 °C at 760 mmHg
Density:	1.532 g/cm³
MDL:	MFCD09265710
LogP:	1.61130

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Related Functional Groups

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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-2021115286-A1	Six-membered and five-membered aromatic ring derivative containing nitrogen heteroatoms which can be used as shp2 inhibitor	20191210
WO-2018089433-A1	PHENYL mTORC INHIBITORS AND USES THEREOF	20161108
US-2018244627-A1	Heterocyclic compounds and uses thereof	20150814
WO-2017030938-A1	Heterocyclic compounds and uses thereof	20150814
US-10723705-B2	Heterocyclic compounds and uses thereof	20150814

Complexity:	130
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.0093748
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	153.0093748
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4