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3-(4-methoxyphenyl)-8,9-dimethyl-2-phenyl-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole

3-(4-methoxyphenyl)-8,9-dimethyl-2-phenyl-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole structure

CAS No:
124405-81-8
Formula:
C26H24N2O2
Chemical Name:
3-(4-methoxyphenyl)-8,9-dimethyl-2-phenyl-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole
Synonyms:
2H-(1)Benzoxepino(5,4-c)pyrazole,4,5-dihydro-8,9-dimethyl-3-(4-methoxyphenyl)-2-phenyl; 4,5-Dihydro-8,9-dimethyl-3-(4-methoxyphenyl)-2-phenyl-2H-(1)benzoxepino(5,4-c)pyrazole;

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3-(4-methoxyphenyl)-8,9-dimethyl-2-phenyl-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole Basic Attributes

Molecular Weight：

396.48100

Exact Mass：

396.183778013

DSSTox ID：

DTXSID10154321

Characteristics

PSA：

36.28000

XLogP3：

5.76660

Density：

1.18g/cm3

Boiling Point：

613.2ºC at 760 mmHg

Flash Point：

324.7ºC

Refractive Index：

1.629

Vapor Pressure：

2.56E-14mmHg at 25°C

Computed Properties

Molecular Weight:396.5
XLogP3:5.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:396.183778013
Monoisotopic Mass:396.183778013
Topological Polar Surface Area:36.3
Heavy Atom Count:30
Complexity:557
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(4-methoxyphenyl)-8,9-dimethyl-2-phenyl-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole

Basic Attributes
Characteristics
Computed Properties

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