4-(Propan-2-yl)-1,3-thiazol-2-amine

HCID 7064077

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Basic information

CAS: 79932-20-0
Standard SMILES: CC(C)c1csc(N)n1
InChIKey: LGPVXXJBWWYOSL-UHFFFAOYSA-N
Molecular formula: C6H10N2S
Average molar mass: 142.22 g/mol
Monoisotopic mass: 142.05646932

Names & identifiers

Preferred name: 4-(Propan-2-yl)-1,3-thiazol-2-amine
IUPAC: 4-propan-2-yl-1,3-thiazol-2-amine
English name: 4-isopropyl-1,3-thiazol-2-amine
Molecular formula: C6H10N2S
Molecular weight: 142.22

Names & synonyms

4-(propan-2-yl)-1,3-thiazol-2-amineRefChem:516746664-231-479932-20-04-isopropyl-1,3-thiazol-2-amine2-Amino-4-isopropylthiazole4-Isopropylthiazol-2-amine4-propan-2-yl-1,3-thiazol-2-amineMFCD076259854-Isopropyl-thiazol-2-ylamine2-Thiazolamine, 4-(1-methylethyl)-4-(methylethyl)-1,3-thiazole-2-ylamine

Show more names

4-propan-2-yl-2-thiazolamine4-(1-Methylethyl)-1,3-thiazol-2-amine4-isopropylthiazol-2-amine - [K87449]4-Isopropyl-1,3-thiazol-2-amine hydrobromide

SCHEMBL190635SCHEMBL2644311SCHEMBL42585924-isopropyl-thiazol-2-yl amineDTXSID50427708LGPVXXJBWWYOSL-UHFFFAOYSA-NALBB-0021974-isopropyl-1,3-thiazol-2-ylamine

Database identifiers

CAS: 79932-20-0
PubChem CID: 7064077
DTXSID: DTXSID50427708
EC Number: 664-231-4
Nikkaji: J1.399.391B

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 67.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 9
Formal charge: 0
Complexity: 95.1

Physicochemical properties

Melting point: 48 · 48-50 °C
Boiling point: 105 · 105-107 °C(Press: 0.5 Torr)
Density: 1.142 · 1.142±0.06 g/cm3(Predicted)
storage temp.: -20 °C · Keep in dark place,Sealed in dry,Store in freezer, under -20°C
solubility: Acetone (Slightly), DMSO (Slightly), Methanol (Slightly)
form: Oil
pka: 5.47 · 5.47±0.10(Predicted)
color: Clear Pale Yellow
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
HazardClass: IRRITANT
HS Code: 2934100090 · 2934100090

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301 (95%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.