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4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate

4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate structure

CAS No:
170917-89-2
Formula:
C20H17ClN2O5
Chemical Name:
4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate
Synonyms:
Indeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylic acid,7-chloro-,4a-methyl 2-(phenylmethyl) ester;4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate

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4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate Basic Attributes

Molecular Weight：

400.815

Exact Mass：

400.81

EC Number：

605-595-6

Characteristics

PSA：

77.4

XLogP3：

3.7

Density：

1.41

Melting Point：

122-125 °C

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:400.8
XLogP3:3.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:400.0825993
Monoisotopic Mass:400.0825993
Topological Polar Surface Area:77.4
Heavy Atom Count:28
Complexity:651
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate

Basic Attributes
Characteristics
Computed Properties
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4a-Methyl 2-(phenylmethyl) 7-chloroindeno[1,2-e][1,3,4]oxadiazine-2,4a(3H,5H)-dicarboxylate

SDS

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