2-(Aminomethyl)-4-methylthiazole - CAS 51221-45-5

Catalog:	BB027372
Product Name:	2-(Aminomethyl)-4-methylthiazole
CAS:	51221-45-5
Synonyms:	(4-methyl-2-thiazolyl)methanamine; (4-methyl-1,3-thiazol-2-yl)methanamine

Technical Data

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Computed Properties

IUPAC Name:	(4-methyl-1,3-thiazol-2-yl)methanamine
Description:	2-(Aminomethyl)-4-methylthiazole (CAS# 51221-45-5) is a useful research chemical.
Molecular Weight:	128.20
Molecular Formula:	C5H8N2S
Canonical SMILES:	CC1=CSC(=N1)CN
InChI:	InChI=1S/C5H8N2S/c1-4-3-8-5(2-6)7-4/h3H,2,6H2,1H3
InChI Key:	OJEGLCVIHVSMMR-UHFFFAOYSA-N
Boiling Point:	207.8 °C at 760 mmHg
Density:	1.182 g/cm³
MDL:	MFCD06740636
LogP:	1.61050

Publication Number	Title	Priority Date
CN-109053623-B	Preparation method of 4-methyl-5-thiazole formaldehyde	20180827
US-2021078975-A1	Fused cyclic urea derivatives as crhr2 antagonist	20180409
WO-2019185631-A1	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo [2, 3-b] pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
AU-2019246220-A1	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo (2, 3-b) pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329
AU-2019246220-B2	4â€"(1hâ€" imidazolâ€" 5â€" yl) -1h-pyrrolo (2, 3-b) pyridines for use in the treatment of leukaemias, lymphomas and solid tumors	20180329

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Related Functional Groups

Oxazole/Thiazole

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	76.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.04081944
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	128.04081944
Rotatable Bond Count:	1
Topological Polar Surface Area:	67.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2