Methyl 3-amino-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

HCID 2769528CAS 119205-38-8

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Basic information

Standard SMILES
COC(=O)c1sc2c(c1N)CCCC2
InChIKey
WBBFZXDFNCRFGM-UHFFFAOYSA-N
Molecular formula
C10H13NO2S
Average molar mass
211.286 g/mol
Monoisotopic mass
211.06669966

Names & identifiers

Preferred name
Methyl 3-amino-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
IUPAC
Methyl 3-amino-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
English name
3-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-2-carboxylic acid methyl ester
Molecular formula
C10H13NO2S
Molecular weight
211.28

Names & synonyms

Methyl 3-aMino-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxylatemethyl 3-amino-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylateEthyl 3-amino-3a,4,5,6,7,7a-hexahydrobenzo[b]thiophene-2-carboxylate3-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-2-carboxylic acid methyl esterBenzo[b]thiophene-2-carboxylic acid, 3-amino-4,5,6,7-tetrahydro-, methyl ester3-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-2-carboxylic acid methyl ester ,97%

Database identifiers

CAS
119205-38-8
PubChem CID
2769528
DTXSID
DTXSID30377752
Nikkaji
J2.914.619E

Properties

Physicochemical properties

Melting point
70 · 70-73 °C
Boiling point
414.3 · 414.3±45.0 °C(Predicted)
Density
1.273 · 1.273±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C(protect from light)
pka
2.24 · 2.24±0.20(Predicted)
Appearance
White to off-white Solid

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Chemistry & industry

Upstream & downstream products

Suppliers26 total

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Hunan Jibang Biological Technology Co., LTD13776644403 · [email protected]
Aladdin Scientific[email protected]

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