2-sec-Butylthiazole

CAT: 0024-sc-265910Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-265910Size:5 g

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CAS Number

18277-27-5

Chemical Information

2-(1-Methylpropyl)thiazole

CAS Number	18277-27-5
PubChem CID	519539
IUPAC Name	2-butan-2-yl-1,3-thiazole
Molecular Formula	C7H11NS
Molecular Weight	141.24
XLogP	2.5
Topological Polar Surface Area	41.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	85

SMILES

CCC(C)C1=NC=CS1

InChI

InChI=1S/C7H11NS/c1-3-6(2)7-8-4-5-9-7/h4-6H,3H2,1-2H3

InChIKey

MHJSWOZJMPIGJQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 18277-27-5

CID: 519539

Formula: C7H11NS

MW: 141.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	141.24
XLogP3	2.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	141.06122053
Monoisotopic Mass	141.06122053
Topological Polar Surface Area	41.1 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	85
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-301015A	Methyl 2-amino-4-t-butylthiazole-5-carboxylate
sc-301015	Methyl 2-amino-4-t-butylthiazole-5-carboxylate
sc-460858	2-Sec-Butoxybenzaldehyde
sc-230664	2-sec-Butylphenol
sc-265909	2-sec-Butylcyclohexanone
sc-230665	2-sec-Butylphenyl isocyanate
sc-354392A	N- (2-sec-butylphenyl) -2-chloropropanamide
sc-354392	N- (2-sec-butylphenyl) -2-chloropropanamide
sc-306120	2-[2- (sec-Butyl) phenoxy]acetohydrazide
sc-487465	4-sec-Butoxy-2-butanone

Catalog	Name
GTR19251538-01	2-Amino-4-tert-butylthiazole
OR78305-01	2-Butylthiazole-4-carboxylic acid
415228-01	2-Amino-5-bromo-4-t-butylthiazole
454815-01	Methyl 2-amino-4-t-butylthiazole-5-carboxylate
419153-01	2-sec-Butylphenol
266321-01	2-Sec-Butoxybenzaldehyde
OR902826-01	2-sec-Butylpyrrolidine
B30330	2-Sec.-Butylphenol
OR929266-01	2-sec-Butylaniline
FAA20536	Sec-butyl 2-bromoacetate