Methyl 2-(2-amino-5-methyl-1,3-thiazol-4-yl)acetate

HCID 2763571
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
259654-73-4
Standard SMILES
COC(=O)Cc1nc(N)sc1C
InChIKey
LJTGLNPZNUZMIZ-UHFFFAOYSA-N
Molecular formula
C7H10N2O2S
Average molar mass
186.23 g/mol
Monoisotopic mass
186.04629874

Names & identifiers

Preferred name
Methyl 2-(2-amino-5-methyl-1,3-thiazol-4-yl)acetate
IUPAC
methyl 2-(2-amino-5-methyl-1,3-thiazol-4-yl)acetate
English name
Methyl 2-(2-AMino-5-Methyl-4-thiazolyl)acetate
Molecular formula
C7H10N2O2S
Molecular weight
186.23

Names & synonyms

259654-73-4methyl 2-(2-amino-5-methyl-1,3-thiazol-4-yl)acetateDTXSID80377025RefChem:813222DTXCID40328053methyl 2-(2-amino-5-methylthiazol-4-yl)acetateMethyl 2-(2-Amino-5-methyl-4-thiazolyl)acetate4-Thiazoleacetic acid, 2-amino-5-methyl-, methyl esterMETHYL (2-AMINO-5-METHYL-1,3-THIAZOL-4-YL)ACETATEMFCD00662517Methyl 2-(2-amino-5-methyl-1,3-thiazol-4-yl)-acetatemethyl 2-(2-amino-5-methyl-thiazol-4-yl)acetate
Show more names
Methyl 2-(2-amino-5-methylthiazol-4-yl)acetat
SCHEMBL750253LJTGLNPZNUZMIZ-UHFFFAOYSA-NSBB090454AKOS005070125DA-07595SY027964CS-0153468methyl2-(2-amino-5-methylthiazol-4-yl)acetate

Database identifiers

CAS
259654-73-4
PubChem CID
2763571
DTXSID
DTXSID80377025
EC Number
110-508-5

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
93.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
12

Physicochemical properties

Boiling point
324.2 · 324.2±27.0 °C(Predicted)
Density
1.297 · 1.297±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C(protect from light)
pka
4.21 · 4.21±0.10(Predicted)
Appearance
Off-white to light yellow Solid

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Chemistry & industry

Upstream & downstream products

Suppliers21 total

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]

Related reactions

12 records
New reaction record

Compound notes

Loading…