1-Hexyn-3-ol, 3-methyl-

Suppliers

Names

[ CAS No. ]:
4339-05-3

[ Name ]:
1-Hexyn-3-ol, 3-methyl-

[Synonym ]:
3-Methyl-1-hexyn-3-ol
Ethynylmethylpropylcarbinol
3-Methyl-hex-1-in-3-ol
Methyl-propyl-aethinyl-carbinol
3-methyl-hex-1-yn-3-ol
Methylpropylacetylenylcarbinol
1-HEXYN-3-OL,3-METHYL

Chemical & Physical Properties

[ Density]:
0.894g/cm3

[ Boiling Point ]:
137.1ºC at 760mmHg

[ Molecular Formula ]:
C7H12O

[ Molecular Weight ]:
112.17000

[ Flash Point ]:
37.8ºC

[ Exact Mass ]:
112.08900

[ PSA ]:
20.23000

[ LogP ]:
1.17070

[ Index of Refraction ]:
1.451

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MR0182300
CHEMICAL NAME :
1-Hexyn-3-ol, 3-methyl-
CAS REGISTRY NUMBER :
4339-05-3
BEILSTEIN REFERENCE NO. :
1740424
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H12-O
MOLECULAR WEIGHT :
112.19
WISWESSER LINE NOTATION :
QX3&1&1UU1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
530 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 5,161,1955

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Pentan-2-one
  • Acetylene
  • sodium acetylide
  • Bromo(ethynyl)magnesium
  • Diethyl ether

DownStream

  • 3-methyl-hex-3-en-1-yne
  • Pentan-2-one
  • Acetylene
  • 3-hydroxy-3-methylhexan-2-one
  • 3-methylhex-1-en-3-ol
  • 3-METHYL-3-HEXANOL
  • 3-methylhex-3-en-2-one
  • 1-Hexyn-3-ol,3-methyl-,carbamate(9CI)

Related Compounds

  • 1-Hexyn-3-ol,3-methyl-,carbamate(9CI)
  • 3-methyl-6-(3-trimethylsilylpropoxy)hex-1-yn-3-ol
  • 5-Hexyn-3-ol,3-methyl-,allophanate(6CI)
  • 4-Hexyn-3-ol, 3-methyl-6-[2-(diisopropylamino)ethoxy]-
  • 3-methyl-6-(2-piperidin-1-ylethoxy)hex-4-yn-3-ol
  • 3-Methyl-5-hexyn-3-ol
  • 2-(Isocyanatomethyl)pyrimidine
  • tert-butyl N-[2-(2-methyloxiran-2-yl)phenyl]carbamate
  • 3-Amino-1-(pyrimidin-2-yl)propan-1-one
  • tert-butyl N-[2-chloro-4-(2-oxoethyl)phenyl]carbamate
  • 3-[(Pyrimidin-2-yl)methyl]azetidin-3-ol
  • 4-(1,3-Oxazol-5-yl)butan-2-amine
  • (2S)-5-cyclohexylpentan-2-ol
  • 3,3,4-Trimethyl-4-phenylpentanoic acid
  • [1-(1-Ethylcyclobutyl)cyclobutyl]methanamine
  • 4-(3-Methylpyridin-4-yl)butan-1-amine
The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.