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4-Methyl-2-pentyne-1,4-diol

4-Methyl-2-pentyne-1,4-diol structure

CAS No:
10605-66-0
Formula:
C6H10O2
Chemical Name:
4-Methyl-2-pentyne-1,4-diol
Synonyms:
2-Pentyne-1,4-diol,4-methyl-;4-Methyl-2-pentyne-1,4-diol;2-Methyl-3-pentyne-2,5-diol

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4-Methyl-2-pentyne-1,4-diol Basic Attributes

Molecular Weight：

114.14 g/mol

Exact Mass：

114.14

EC Number：

234-235-7

UNII：

MC6RG6N5HQ

DSSTox ID：

DTXSID00147489

Characteristics

PSA：

40.5 Å²

Density：

1.029 g/cm³ @ Temp: 17 °C

Boiling Point：

102-103 °C @ Press: 2 Torr

Computed Properties

Molecular Weight:114.14
XLogP3:-0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:114.068079557
Monoisotopic Mass:114.068079557
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:124
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Methyl-2-pentyne-1,4-diol

Basic Attributes
Characteristics
Computed Properties

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