2-Thiazolemethanol - CAS 14542-12-2

Catalog:	BB009937
Product Name:	2-Thiazolemethanol
CAS:	14542-12-2
Synonyms:	2-thiazolylmethanol; 1,3-thiazol-2-ylmethanol

Technical Data

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Computed Properties

IUPAC Name:	1,3-thiazol-2-ylmethanol
Description:	2-Thiazolemethanol (CAS# 14542-12-2) is a reagent used in the synthesis of quinazoline analogs which is an anti-proliferative activities and EGFR inhibitory potency.
Molecular Weight:	115.15
Molecular Formula:	C4H5NOS
Canonical SMILES:	C1=CSC(=N1)CO
InChI:	InChI=1S/C4H5NOS/c6-3-4-5-1-2-7-4/h1-2,6H,3H2
InChI Key:	JNHDLNXNYPLBMJ-UHFFFAOYSA-N
Boiling Point:	212.1 °C at 760 mmHg
Density:	1.339 g/cm³
MDL:	MFCD06200855
LogP:	0.63540

Publication Number	Title	Priority Date
CN-112521384-A	Synthesis of benzothiazinopentalene derivative by solvothermal one-pot method	20210113
KR-20210094191-A	Photo-decomposable compound, photoresist composition comprising the same, and method of manufacturing integrated circuit device	20200120
US-2021223692-A1	Photo-decomposable compound, photoresist composition including the same, and method of manufacturing integrated circuit device	20200120
WO-2021062318-A1	Thiazole carboxamide compounds and use thereof for the treatment of mycobacterial infections	20190926
WO-2021050700-A1	Cyclooxygenase-2 inhibitors and uses thereof	20190913

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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+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	59.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	115.00918496
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	115.00918496
Rotatable Bond Count:	1
Topological Polar Surface Area:	61.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1