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1-BUTAN-D9-OL

1-BUTAN-D9-OL structure

CAS No:
25493-17-8
Formula:
C4HD9O
Chemical Name:
1-BUTAN-D9-OL
Synonyms:
N-BUTANOL (D9);N-BUTYL-D9 ALCOHOL;BUTYL-D9 ALCOHOL;1-BUTANOL-D9;1-BUTAN-D9-OL;1,1,2,2,3,3,4,4,4-nonadeuteriobutan-1-ol

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Description

Clear Colourless Oil

1-BUTAN-D9-OL Basic Attributes

Molecular Weight：

83.18

Exact Mass：

83.129654

DSSTox ID：

DTXSID20708652

Characteristics

PSA：

20.2

XLogP3：

0.88

Density：

0.8±0.1 g/cm3

Melting Point：

-90 °C(lit.)

Boiling Point：

116-118 °C(lit.)

Flash Point：

35 °C

Refractive Index：

1.396

Safety Information

Transport codes：

UN 1120 3/PG 3

wgk germany：

hazard class code：

10-22-37/38-41-67

safety instructions：

13-26-37/39-46-7/9

Marks：

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H226-H302-H315-H318-H335 + H336

1-BUTAN-D9-OL Use and Manufacturing

1-Butan-d9-ol is the labeled form of 1-Butanol, which is used for the production of dimethylfuran for liquid fuels.

Computed Properties

Molecular Weight:83.18
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:83.129655652
Monoisotopic Mass:83.129655652
Topological Polar Surface Area:20.2
Heavy Atom Count:5
Complexity:13.1
Isotope Atom Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-BUTAN-D9-OL

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

1-BUTAN-D9-OL

SDS

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