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(R)-(−)-1,3-Butanediol

95%

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About This Item

Linear Formula:
CH3CH(OH)CH2CH2OH
CAS Number:
6290-03-5
Molecular Weight:
90.12
Beilstein/REAXYS Number:
1718944
EC Number:
228-532-0
MDL number:
MFCD00064277
UNSPSC Code:
12352001
PubChem Substance ID:
24854257
NACRES:
NA.22

vapor density

3.1 (vs air)

vapor pressure

0.06 mmHg ( 20 °C)

assay

95%

form

liquid

optical activity

[α]21/D −31.0°, c = 1 in ethanol

optical purity

ee: 95% (GLC)

autoignition temp.

741 °F

bp

107-110 °C/23 mmHg (lit.)

density

1.005 g/mL at 25 °C (lit.)

SMILES string

C[C@@H](O)CCO

InChI

1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3/t4-/m1/s1

InChI key

PUPZLCDOIYMWBV-SCSAIBSYSA-N

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Storage Class

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Mário T S Rosado et al.
The journal of physical chemistry. A, 113(26), 7499-7507 (2009-04-25)
The complete conformational space of monomeric 1,3-butanediol has been characterized theoretically, and 73 unique stable conformers were found at the MP2/6-311++G(d,p) level. These were classified into nine families whose members share the same heavy atom backbone configurations and differ in
Allergic contact dermatitis due to 1,3-butylene glycol in medicaments.
Naoki Oiso et al.
Contact dermatitis, 51(1), 40-41 (2004-08-05)
Tamara Kujawska et al.
Ultrasonics, 51(8), 997-1005 (2011-07-05)
This work addresses the difficulties in the measurements of the nonlinear medium parameter B/A and presents a modification of the finite amplitude method (FAM), one of the accepted procedures to determine this parameter. The modification is based on iterative, hybrid
Su Jeong Kim et al.
Nucleosides, nucleotides & nucleic acids, 22(11), 2003-2011 (2003-12-19)
Two optically active phosphoramidite monomers for modified oligodeoxyribonucleotides were prepared. These monomers were then introduced into dodecanucleotides in the middle of the sequences. The modified dodecanucleotides were characterized by various analytical methods including MALDI-TOF mass spectrometry and Tm values were
Q Wu et al.
Guang pu xue yu guang pu fen xi = Guang pu, 20(5), 612-613 (2003-08-30)
In the present paper, we studied the surface structure effect of Pt electrode modified with antimony and sulfur adatoms towards 1,3-Butanediol oxidation. The results demonstrated that the modification of Sb and S both inhibited the dissociative adsorption of 1,3-Butanediol into
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