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1,2,7-HEPTANETRIOL

1,2,7-HEPTANETRIOL structure

CAS No:
37939-50-7
Formula:
C7H16O3
Chemical Name:
1,2,7-HEPTANETRIOL
Synonyms:
1,2,7-HEPTANETRIOL;1,2,7-HEPTANETRIOL 95+%;1,4,7-Heptanetriol;1,4,7-Trihydroxyheptane;1,2,7-Heptanetriol>

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1,2,7-HEPTANETRIOL Basic Attributes

Molecular Weight：

148.2

Exact Mass：

148.109944368

DSSTox ID：

DTXSID70599436

Characteristics

Density：

1.081±0.06 g/cm3

Boiling Point：

323.9±22.0 °C(Predicted)

Refractive Index：

1.4700 to 1.4740

PKA：

14.43±0.20

Computed Properties

Molecular Weight:148.20
XLogP3:-0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:148.109944368
Monoisotopic Mass:148.109944368
Topological Polar Surface Area:60.7
Heavy Atom Count:10
Complexity:65.9
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2,7-HEPTANETRIOL

Basic Attributes
Characteristics
Computed Properties

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