(5-Bromo-2-chloro-pyridin-3-yl)-methanol - CAS 742100-75-0

Name: (5-Bromo-2-chloro-pyridin-3-yl)-methanol
Brand: BOC Sciences
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Catalog:	BB035029
Product Name:	(5-Bromo-2-chloro-pyridin-3-yl)-methanol
CAS:	742100-75-0
Synonyms:	(5-bromo-2-chloropyridin-3-yl)methanol

Technical Data

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Patents

Computed Properties

IUPAC Name:	(5-bromo-2-chloropyridin-3-yl)methanol
Description:	(5-Bromo-2-chloro-pyridin-3-yl)-methanol (CAS# 742100-75-0 ) is a useful research chemical.
Molecular Weight:	222.47
Molecular Formula:	C6H5BrClNO
Canonical SMILES:	C1=C(C(=NC=C1Br)Cl)CO
InChI:	InChI=1S/C6H5BrClNO/c7-5-1-4(3-10)6(8)9-2-5/h1-2,10H,3H2
InChI Key:	ZZGSPGXWLOYKFH-UHFFFAOYSA-N
Boiling Point:	320.5 °C at 760 mmHg
Density:	1.785 g/cm³
Appearance:	White to off-white powder or crystalline powder
MDL:	MFCD08688594
LogP:	1.98980

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Related Functional Groups

Alcohols and Derivatives

[58287-18-6]C8H9NO3
(1R)-1-(4-Nitrophenyl)ethanol
[77987-49-6]C10H13NO3
Z-Glycinol
[1946823-77-3]C7H9F3N2O
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[162894-76-0]C2H7NO3S
2-Hydroxyethane-1-sulfonamide
[2058331-75-0]C3H5BrF2O
3-Bromo-1,1-difluoro-2-propanol
[1328640-72-7]C6H9N3O3
(1-Ethyl-3-nitro-1H-pyrazol-5-YL)methanol

Pyridines

[202288-73-1]C12H14Cl2N2O
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[942206-23-7]C5H2Cl2IN
2,5-Dichloro-3-iodopyridine
[1122-43-6]C7H9NO
3-Hydroxy-2,6-dimethylpyridine
[133928-61-7]C12H9ClN2O
4-Chloro-N-phenylpicolinamide
[1214336-44-3]C7H5BrFNO2
Methyl 5-bromo-6-fluoropicolinate
[6295-87-0]C5H7IN2
1-Aminopyridinium iodide

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021126729-A1	Prmt5 inhibitors	20191217
BR-112019012782-A2	COMPOUND, PHARMACEUTICAL COMPOSITION, TNAP INHIBITOR, USE OF A COMPOUND, AND, METHOD FOR TREATING OR PROPHYLAXIS OF A DISEASE OR CONDITION AND TO INHIBIT TNAP IN AN INDIVIDUAL.	20161223
CA-3045492-A1	Sulfonamide compounds having tnap inhibitory activity	20161223
EP-3559007-A1	Sulfonamide compounds having tnap inhibitory activity	20161223
JP-2020514268-A	Sulfonamide compound having TNAP inhibitory activity	20161223

Complexity:	114
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	220.9243
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	220.9243
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6