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Merck
CN

396729

(2S,5S)-2,5-Hexanediol

99%, optical purity ee: 99% (GLC)

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About This Item

Linear Formula:
CH3CH(OH)CH2CH2CH(OH)CH3
CAS Number:
Molecular Weight:
118.17
PubChem Substance ID:
UNSPSC Code:
12352001
Beilstein/REAXYS Number:
4652444
MDL number:
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SMILES string

C[C@H](O)CC[C@H](C)O

InChI

1S/C6H14O2/c1-5(7)3-4-6(2)8/h5-8H,3-4H2,1-2H3/t5-,6-/m0/s1

InChI key

OHMBHFSEKCCCBW-WDSKDSINSA-N

assay

99%

optical activity

[α]20/D +34.5°, c = 9 in chloroform

optical purity

ee: 99% (GLC)

bp

212-215 °C (lit.)

mp

50-53 °C (lit.)

Application

Used in the synthesis of phospholanes. A building block in the synthesis of trans-2,5-dimethylpyrrolidine. C2 symmetric chiral diol with versatile applications as a chiral auxiliary, building block, and chiral ligand.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

215.6 °F - closed cup

flash_point_c

102 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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The Journal of Organic Chemistry, 54, 1755-1755 (1989)
Tetrahedron Asymmetry, 2, 569-569 (1991)
Burk, M.J. et al.
Tetrahedron Asymmetry, 2, 569-569 (1991)
Matteson, D.S. Man, H.-W.
The Journal of Organic Chemistry, 59, 5734-5734 (1994)
Pichon, M. Figadere, B.
Tetrahedron Asymmetry, 7, 927-927 (1996)

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