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1-phenylbut-2-yne-1,4-diol

1-phenylbut-2-yne-1,4-diol structure

CAS No:
29021-82-7
Formula:
C10H10O2
Chemical Name:
1-phenylbut-2-yne-1,4-diol
Synonyms:
1-phenylbut-2-yne-1,4-diol;29021-82-7;1-Phenyl-2-butyne-1,4-diol;C10H10O2;NSC141471;SCHEMBL9547886;CHEMBL3800492;2-Butyne-1,4-diol,1-phenyl-;DTXSID10951630;STK623876;AKOS005556947;MCULE-9813659804;NSC-141471;DS-003977

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1-phenylbut-2-yne-1,4-diol Basic Attributes

Molecular Weight：

162.18 g/mol

Exact Mass：

162.068079557 g/mol

NSC Number：

141471

Characteristics

PSA：

40.5 Å²

Computed Properties

Molecular Weight:162.18
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:162.068079557
Monoisotopic Mass:162.068079557
Topological Polar Surface Area:40.5
Heavy Atom Count:12
Complexity:181
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-phenylbut-2-yne-1,4-diol

Basic Attributes
Characteristics
Computed Properties

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