 Home > Encyclopedia > 2-chloro-4-nitro-N-(2-spiro[1,2,3,3a-tetrahydrocyclopenta[c][1,5]benzodiazepine-4,1'-cyclopentane]-5-ylethyl)aniline

2-chloro-4-nitro-N-(2-spiro[1,2,3,3a-tetrahydrocyclopenta[c][1,5]benzodiazepine-4,1'-cyclopentane]-5-ylethyl)aniline

2-chloro-4-nitro-N-(2-spiro[1,2,3,3a-tetrahydrocyclopenta[c][1,5]benzodiazepine-4,1'-cyclopentane]-5-ylethyl)aniline structure

CAS No:
133307-99-0
Formula:
C24H27ClN4O2
Chemical Name:
2-chloro-4-nitro-N-(2-spiro[1,2,3,3a-tetrahydrocyclopenta[c][1,5]benzodiazepine-4,1'-cyclopentane]-5-ylethyl)aniline
Synonyms:
Spiro(benzo(b)cyclopenta(e)(1,4)diazepine-10(9H),1'-cyclopentane)-9-ethanamine,1,2,3,10a-tetrahydro-N-(2-chloro-4-nitrophenyl);

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2-chloro-4-nitro-N-(2-spiro[1,2,3,3a-tetrahydrocyclopenta[c][1,5]benzodiazepine-4,1'-cyclopentane]-5-ylethyl)aniline Basic Attributes

Molecular Weight：

438.95000

Exact Mass：

438.1822538

Characteristics

PSA：

73.45000

XLogP3：

6.46250

Density：

1.38g/cm3

Boiling Point：

628.6ºC

Flash Point：

333.9ºC

Refractive Index：

1.692

Vapor Pressure：

1.04E-15mmHg at 25°C

Computed Properties

Molecular Weight:438.9
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:438.1822538
Monoisotopic Mass:438.1822538
Topological Polar Surface Area:73.4
Heavy Atom Count:31
Complexity:690
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-chloro-4-nitro-N-(2-spiro[1,2,3,3a-tetrahydrocyclopenta[c][1,5]benzodiazepine-4,1'-cyclopentane]-5-ylethyl)aniline

Basic Attributes
Characteristics
Computed Properties

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