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5-tert-butylcyclohept-2-en-1-one

5-tert-butylcyclohept-2-en-1-one structure

CAS No:
71837-43-9
Formula:
C11H18O
Chemical Name:
5-tert-butylcyclohept-2-en-1-one
Synonyms:
71837-43-9;5-tert-butylcyclohept-2-en-1-one;NSC312796;2-Cyclohepten-1-one, 5-(1,1-dimethylethyl)-;DTXSID90317210;NSC-312796

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5-tert-butylcyclohept-2-en-1-one Basic Attributes

Molecular Weight：

166.26 g/mol

Exact Mass：

166.135765193 g/mol

NSC Number：

312796

DSSTox ID：

DTXSID90317210

Characteristics

PSA：

17.1 Å²

Computed Properties

Molecular Weight:166.26
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:166.135765193
Monoisotopic Mass:166.135765193
Topological Polar Surface Area:17.1
Heavy Atom Count:12
Complexity:196
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-tert-butylcyclohept-2-en-1-one

Basic Attributes
Characteristics
Computed Properties

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