(2S,4S)-(+)-Pentanediol - CAS 72345-23-4

Inquiry

(2S,4S)-(+)-Pentanediol is an optically active reagent used to prepare NIP-101, a potent calcium receptor antagonist.

Catalog Number

72345-23-4

CAS

72345-23-4

IUPAC Name

(2S,4S)-pentane-2,4-diol

Synonyms

2,4-Pentanediol, (2S,4S)-; (2S,4S)-2,4-Pentanediol; 2,4-Pentanediol, [S-(R*,R*)]-; (+)-(2S,4S)-Pentanediol; (+)-2,4-Pentanediol; (2S,4S)-(+)-2,4-Pentanediol; (2S,4S)-Pentanediol; (S,S)-(+)-2,4-Pentanediol; (S,S)-2,4-Pentanediol

Molecular Weight

104.15

Molecular Formula

C5H12O2

Product Information

Canonical SMILES

CC(CC(C)O)O

InChI

InChI=1S/C5H12O2/c1-4(6)3-5(2)7/h4-7H,3H2,1-2H3/t4-,5-/m0/s1

InChI Key

GTCCGKPBSJZVRZ-WHFBIAKZSA-N

Purity

≥95%

MDL

MFCD00064276

Physical State

Solid

Appearance

White Crystalline Powder

Storage

Store at RT under inert atmosphere

Boiling Point

111-113°C at 19 Torr

Melting Point

50.5°C

Flash Point

101 °C(213.8 °F)

Density

0.974±0.06 g/cm3

Optical Activity

+39.8°( c = 10 in chloroform)

WGK Germany

Safety Information

Precautionary Statement

P261 - P305 - P351 - P338

Hazard Statements

H302 - H315 - H319 - H335

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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(2S,4S)-(+)-Pentanediol - CAS 72345-23-4

Product Information

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