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3,6-dimethoxybicyclo[4.2.0]octa-2,4-diene-7-carbonitrile

3,6-dimethoxybicyclo[4.2.0]octa-2,4-diene-7-carbonitrile structure

CAS No:
88729-12-8
Formula:
C11H13NO2
Chemical Name:
3,6-dimethoxybicyclo[4.2.0]octa-2,4-diene-7-carbonitrile
Synonyms:
88729-12-8;Bicyclo[4.2.0]octa-2,4-diene-7-carbonitrile, 3,6-dimethoxy-;NSC600572;ACMC-20ldfn;DTXSID80326538;NSC-600572

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3,6-dimethoxybicyclo[4.2.0]octa-2,4-diene-7-carbonitrile Basic Attributes

Molecular Weight：

191.23 g/mol

Exact Mass：

191.094628657 g/mol

NSC Number：

600572

DSSTox ID：

DTXSID80326538

Characteristics

PSA：

42.2 Å²

Computed Properties

Molecular Weight:191.23
XLogP3:0.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:191.094628657
Monoisotopic Mass:191.094628657
Topological Polar Surface Area:42.2
Heavy Atom Count:14
Complexity:350
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,6-dimethoxybicyclo[4.2.0]octa-2,4-diene-7-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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