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N-Ethyl-1,3-thiazol-2-amine

HCID 13699275
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
13472-75-8
Standard SMILES
CCNc1nccs1
InChIKey
LUWSZVRMLJKYML-UHFFFAOYSA-N
Molecular formula
C5H8N2S
Average molar mass
128.2 g/mol
Monoisotopic mass
128.04081926

Names & identifiers

Preferred name
N-Ethyl-1,3-thiazol-2-amine
IUPAC
N-ethyl-1,3-thiazol-2-amine
English name
Ethyl-thiazol-2-yl-amine
Molecular formula
C5H8N2S
Molecular weight
128.2

Names & synonyms

13472-75-8N-ethyl-1,3-thiazol-2-amineDTXSID50547031RefChem:363912DTXCID00497815866-946-9ETHYL-THIAZOL-2-YL-AMINEN-ethylthiazol-2-amineMFCD099979162-Thiazolamine, N-ethyl-2-EthylaminothiazoleSCHEMBL306157
Show more names
SCHEMBL982516SCHEMBL1680450SCHEMBL5324283LUWSZVRMLJKYML-UHFFFAOYSA-NNAA47275UKRORGSYN-BB BBR-027787AKOS008994898SB32948

Database identifiers

CAS
13472-75-8
PubChem CID
13699275
DTXSID
DTXSID50547031
EC Number
866-946-9
Nikkaji
J390.656F

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
53.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
8
Formal charge
0
Complexity
67.4

Physicochemical properties

Melting point
52.5 · 52.5-53.5 °C
Boiling point
191.4 · 191.4±23.0 °C(Predicted)
Density
1.185 · 1.185±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C, protect from light
pka
5.3 · 5.30±0.10(Predicted)
Appearance
White to off-white Solid
Symbol(GHS)
7 · GHS07,GHS05
Signal word
Danger
Hazard statements
335 · H335-H302-H332-H318-H315-H312
Precautionary statements
280 · P280-P305+P351+P338-P310-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

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

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 (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%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS07,GHS05
Hazard statements
H335-H302-H332-H318-H315-H312
Precautionary statements
P280-P305+P351+P338-P310-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501

Chemistry & industry

Suppliers11 total

上海爱孜康医药研究有限公司18721109360 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
杰达维(上海)医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
上海智乾生物科技有限公司[email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
佰美济华(河南)医药科技有限公司0371-88900765 18037465274 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]

Related reactions

5 records
New reaction record
HRID 297236 reaction equation
HRID 297236As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 419067 reaction equation
HRID 419067As productAs reactantuspto-grants-2012_01
HRID 490809 reaction equation
HRID 490809As reactantuspto-grants-2009_05
HRID 1438510 reaction equation
HRID 1438510As productAs reactantuspto-grants-2009_11
HRID 1898072 reaction equation
HRID 1898072As productAs reactantuspto-grants-2013_08

Compound notes

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