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ETHYL 2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE-4-CARBOXYLATE

ETHYL 2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE-4-CARBOXYLATE structure

CAS No:
412027-25-9
Formula:
C13H15NO3
Chemical Name:
ETHYL 2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE-4-CARBOXYLATE
Synonyms:
ETHYL 2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE-4-CARBOXYLATE

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ETHYL 2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE-4-CARBOXYLATE Basic Attributes

Molecular Weight：

233.2631

Exact Mass：

233.10500

DSSTox ID：

DTXSID60743224

HScode：

2933990090

Characteristics

PSA：

55.4

XLogP3：

1.83570

Density：

1.163g/cm3

Boiling Point：

400.457ºC at 760 mmHg

Flash Point：

195.99ºC

Refractive Index：

1.531

Computed Properties

Molecular Weight:233.26
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:233.10519334
Monoisotopic Mass:233.10519334
Topological Polar Surface Area:55.4
Heavy Atom Count:17
Complexity:303
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ETHYL 2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE-4-CARBOXYLATE

Basic Attributes
Characteristics
Computed Properties
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ETHYL 2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE-4-CARBOXYLATE

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