CCOC(=O)C1=C(N=C(S1)Br)C
CAS: 22900-83-0
Nom: ethyl 2-bromo-4-methyl-1,3-thiazole-5-carboxylate
SMILES: CCOC(=O)C1=C(N=C(S1)Br)C

Molecular Processing

Molecular formula
C7H8BrNO2S
Molecular weight
250.12
Exact mass
248.9459
XLogP
2.39
TPSA
39.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
50.51

Supplementary Information

InChIKey: CFBIOWPDDZPIDP-UHFFFAOYSA-N
Synonymes
ethyl 2-bromo-4-methyl-1,3-thiazole-5-carboxylateRefChem:594247626-889-022900-83-0Ethyl 2-bromo-4-methylthiazole-5-carboxylate5-Thiazolecarboxylic acid, 2-bromo-4-methyl-, ethyl esterMFCD037912272-Bromo-4-methyl-thiazole-5-carboxylic acid ethyl ester2-bromo-4-methylthiazole-5-carboxylic acid ethyl esterethyl 2-bromo-4-methyl-5-thiazolecarboxylateMaybridge3_004543SCHEMBL288785CHEMBL5199359DTXSID50384968ETHYL2-BROMO-4-METHYL-1,3-THIAZOLE-5-CARBOXYLATECFBIOWPDDZPIDP-UHFFFAOYSA-NHMS1443O11ALBB-027183BBL030101SBB073215AKOS002339532CCG-251658CS-W007525FE32887IDI1_015930AC-30154SY029872DB-000711E0945Ethyl2-bromo-4-methylthiazole-5-carboxylate
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Recherche Etendue

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