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1-nitrobutan-2-ol

1-nitrobutan-2-ol structure

CAS No:
3156-74-9
Formula:
C4H9NO3
Chemical Name:
1-nitrobutan-2-ol
Synonyms:
1-nitro-2-butanol; 2-Butanol, 1-nitro-; 2-Butanol,1-nitro; 1-nitro-butan-2-ol; 2-hydroxy-1-nitrobutane; 1-nitromethylpropan-1-ol; nitromethyl-ethyl-carbinol;Expand

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1-nitrobutan-2-ol Basic Attributes

Molecular Weight：

119.11900

Exact Mass：

119.058243149 g/mol

NSC Number：

17678

Characteristics

PSA：

66.05000

XLogP3：

0.55720

Density：

1.132g/cm3

Boiling Point：

214.4ºC at 760mmHg

Flash Point：

97.7ºC

Refractive Index：

1.446

Computed Properties

Molecular Weight:119.12
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:119.058243149
Monoisotopic Mass:119.058243149
Topological Polar Surface Area:66
Heavy Atom Count:8
Complexity:77.8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-nitrobutan-2-ol

Basic Attributes
Characteristics
Computed Properties

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