3-Methyl-1,5-pentanediol

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Names

[ CAS No. ]:
4457-71-0

[ Name ]:
3-Methyl-1,5-pentanediol

[Synonym ]:
1,5-Dihydroxy-3-methylpentane
3-methylpentane-1,5-diol
EINECS 224-709-1
MFCD00039547

Chemical & Physical Properties

[ Density]:
0.974 g/mL at 20 °C(lit.)

[ Boiling Point ]:
150 °C / 25mmHg

[ Molecular Formula ]:
C6H14O2

[ Molecular Weight ]:
118.17400

[ Flash Point ]:
143°C

[ Exact Mass ]:
118.09900

[ PSA ]:
40.46000

[ LogP ]:
0.38730

[ Index of Refraction ]:
n20/D 1.454

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SA0800000
CHEMICAL NAME :
1,5-Pentanediol, 3-methyl-
CAS REGISTRY NUMBER :
4457-71-0
BEILSTEIN REFERENCE NO. :
1697331
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C6-H14-O2
MOLECULAR WEIGHT :
118.20
WISWESSER LINE NOTATION :
Q2Y1&2Q

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
320 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01094

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves

[ Safety Phrases ]:
S23-S24/25

[ RIDADR ]:
1987

[ WGK Germany ]:
1

[ RTECS ]:
SA0800000

[ HS Code ]:
2905399090

Synthetic Route

Click to get detail synthetic route

Customs

[ HS Code ]: 2905399090

[ Summary ]:
2905399090 other diols。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:5.5%。general tariff:30.0%

Related Compounds

  • Poly(3-methyl-1,5-pentanediol adipate)
  • Dineopentanoic acid 3-methyl-1,5-pentanediol
  • 1,4-Benzenedicarboxylic acid, polymer with 3-methyl-1,5-pentanediol
  • 3-methyl-1,5-diphenyl-5-trimethylsilyloxypent-4-en-1-one
  • 3-methyl-1-[(5-nitro-2-furyl)methylideneamino]urea
  • 3-methyl-1,5,8-tris(trimethylsilyloxy)anthracene-9,10-dione
  • 2-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)morpholine hydrochloride
  • (2-Methanesulfonyl-2-methylpropyl)(methyl)amine hydrochloride
  • 2-Amino-3-(4-fluorophenyl)-2-methylpropan-1-ol hydrochloride
  • 2,4-Dimethoxypyridine-3-carboxylic acid hydrochloride
  • 4-(1-methyl-1H-imidazol-2-yl)piperidin-4-ol dihydrochloride
  • 3-amino-N,N-dimethylazetidine-1-sulfonamide hydrochloride
  • 1-[(4-Bromophenyl)methyl]piperazin-2-one hydrochloride
  • 4-Amino-3-(3-methylcyclohexyl)butanoic acid hydrochloride
  • 2-Amino-1-(pyridin-2-yl)propane-1,3-diol dihydrochloride
  • 1-(5-Methoxypyridin-3-yl)piperazine dihydrochloride
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