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3,4-DIMETHYL-1-PENTYN-3-OL

3,4-DIMETHYL-1-PENTYN-3-OL structure

CAS No:
1482-15-1
Formula:
C7H12O
Chemical Name:
3,4-DIMETHYL-1-PENTYN-3-OL
Synonyms:
TIMTEC-BBSBB008720;Dimethylpentynoltech;3,4-Dimethyl-1-penten-3-ol;3,4-Dimethyl-4-pentyn-3-ol;3,4-DIMETHYL-1-PENTYN-3-OL;ETHYNYLISOPROPYLMETHYLCARBINOL;3,4-Dimethyl-1-pentyn-3-ol,tech.,94%;(1,2-DIMETHYL-1-HYDROXYPROPYL)ACETYLENE
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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3,4-DIMETHYL-1-PENTYN-3-OL Basic Attributes

Molecular Weight：

112.172

Exact Mass：

112.088814

NSC Number：

14253

DSSTox ID：

DTXSID9022154

HScode：

2905290000

Characteristics

PSA：

20.2

XLogP3：

1.20

Density：

0,87 g/cm 3

Melting Point：

-20.62°C (estimate)

Boiling Point：

133°C

Flash Point：

133°C

Refractive Index：

1.4360-1.4380

Water Solubility：

Fully miscible in water.

Vapor Pressure：

3.19mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

1987

hazard class code：

safety instructions：

Marks：

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:112.17
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:112.088815002
Monoisotopic Mass:112.088815002
Topological Polar Surface Area:20.2
Heavy Atom Count:8
Complexity:118
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,4-DIMETHYL-1-PENTYN-3-OL

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

3,4-DIMETHYL-1-PENTYN-3-OL

SDS

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