 Home > Encyclopedia > 11-carboxy-2,3,5,10,11,11a-hexahydro-5,10-dioxo-1H-benzopyrrolo<1,2-a>indole-11-acetic acid, dimethyl ester

11-carboxy-2,3,5,10,11,11a-hexahydro-5,10-dioxo-1H-benzopyrrolo<1,2-a>indole-11-acetic acid, dimethyl ester

11-carboxy-2,3,5,10,11,11a-hexahydro-5,10-dioxo-1H-benzopyrrolo<1,2-a>indole-11-acetic acid, dimethyl ester structure

CAS No:
70779-56-5
Formula:
C20H19NO6
Chemical Name:
11-carboxy-2,3,5,10,11,11a-hexahydro-5,10-dioxo-1H-benzopyrrolo<1,2-a>indole-11-acetic acid, dimethyl ester
Synonyms:
11-carboxy-2,3,5,10,11,11a-hexahydro-5,10-dioxo-1H-benzopyrrolo<1,2-a>indole-11-acetic acid,dimethyl ester; 11-methoxycarbonylmethyl-5,10-dioxo-2,3,5,10,11,11a-hexahydro-1H-benzo[f]pyrrolo[1,2-a]indole-11-carboxylic acid methyl ester; THT-10;

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11-carboxy-2,3,5,10,11,11a-hexahydro-5,10-dioxo-1H-benzopyrrolo<1,2-a>indole-11-acetic acid, dimethyl ester Basic Attributes

Molecular Weight：

369.36800

Exact Mass：

369.12123733 g/mol

NSC Number：

327442

DSSTox ID：

DTXSID50318228

Characteristics

PSA：

89.98000

XLogP3：

1.45810

Density：

1.4g/cm3

Boiling Point：

511ºC

Flash Point：

262.9ºC

Refractive Index：

1.623

Computed Properties

Molecular Weight:369.4
XLogP3:1.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:369.12123733
Monoisotopic Mass:369.12123733
Topological Polar Surface Area:90
Heavy Atom Count:27
Complexity:756
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 11-carboxy-2,3,5,10,11,11a-hexahydro-5,10-dioxo-1H-benzopyrrolo<1,2-a>indole-11-acetic acid, dimethyl ester

Basic Attributes
Characteristics
Computed Properties
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