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METHYL4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-2-CARBOXYLATE

METHYL4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-2-CARBOXYLATE structure

CAS No:
91489-09-7
Formula:
C10H12O2S
Chemical Name:
METHYL4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-2-CARBOXYLATE
Synonyms:
methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate;methyl 4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxylate;METHYL4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-2-CARBOXYLATE;SCHEMBL7218427;DTXSID00393545;HMS1783D10;ALBB-031700;ZINC3887000;3028AF;AKOS000117005

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METHYL4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-2-CARBOXYLATE Basic Attributes

Molecular Weight：

196.26600

Exact Mass：

196.05600

DSSTox ID：

DTXSID00393545

HScode：

2934999090

Characteristics

PSA：

54.54000

XLogP3：

2.41350

Density：

1.199g/cm3

Boiling Point：

334.3ºC at 760mmHg

Flash Point：

156ºC

Refractive Index：

1.563

Computed Properties

Molecular Weight:196.27
XLogP3:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:196.05580079
Monoisotopic Mass:196.05580079
Topological Polar Surface Area:54.5
Heavy Atom Count:13
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of METHYL4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-2-CARBOXYLATE

Basic Attributes
Characteristics
Computed Properties

METHYL4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-2-CARBOXYLATE

SDS

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