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2-(1H-benzimidazol-2-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

2-(1H-benzimidazol-2-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione structure

CAS No:
16131-77-4
Formula:
C15H15N3O2
Chemical Name:
2-(1H-benzimidazol-2-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

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2-(1H-benzimidazol-2-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Basic Attributes

Molecular Weight：

269.29900

Exact Mass：

269.116426730 g/mol

NSC Number：

80815

DSSTox ID：

DTXSID60292207

Characteristics

PSA：

66.06000

XLogP3：

2.30750

Density：

1.383g/cm3

Boiling Point：

487.8ºC

Flash Point：

248.8ºC

Refractive Index：

1.68

Vapor Pressure：

1.15E-09mmHg at 25°C

Computed Properties

Molecular Weight:269.30
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:269.116426730
Monoisotopic Mass:269.116426730
Topological Polar Surface Area:66.1
Heavy Atom Count:20
Complexity:415
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1H-benzimidazol-2-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Basic Attributes
Characteristics
Computed Properties

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