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2-Propyl-1,3-propanediol

2-Propyl-1,3-propanediol structure

CAS No:
2612-28-4
Formula:
C6H14O2
Chemical Name:
2-Propyl-1,3-propanediol
Synonyms:
1,3-Propanediol,2-propyl-;2-Propyl-1,3-propanediol
Categories:
Specialty Chemicals

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2-Propyl-1,3-propanediol Basic Attributes

Molecular Weight：

118.17

Exact Mass：

118.17

EC Number：

607-868-5

DSSTox ID：

DTXSID30427342

HScode：

2905399090

Characteristics

PSA：

40.5

XLogP3：

0.6

Density：

0.9659 g/cm³ @ Temp: 20 °C

Melting Point：

26.38°C (estimate)

Boiling Point：

95-108 °C @ Press: 0.05 Torr

Flash Point：

107.3ºC

Refractive Index：

1.447

Safety Information

hazard class code：

20/21-65

safety instructions：

23-36/37/39

Computed Properties

Molecular Weight:118.17
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:118.099379685
Monoisotopic Mass:118.099379685
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:41.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes