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Merck
CN

237620

(S)-(+)-1,3-丁二醇

98%

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关于此项目

线性分子式:
CH3CH(OH)CH2CH2OH
化学文摘社编号:
分子量:
90.12
EC Number:
246-363-0
UNSPSC Code:
12352001
PubChem Substance ID:
Beilstein/REAXYS Number:
1718943
MDL number:
Assay:
98%
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vapor density

3.1 (vs air)

vapor pressure

0.06 mmHg ( 20 °C)

assay

98%

optical activity

[α]20/D +30°, c = 1 in ethanol

optical purity

ee: 96% (GLC)

autoignition temp.

741 °F

refractive index

n20/D 1.440 (lit.)

bp

109 °C/14 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-/m0/s1

InChI key

PUPZLCDOIYMWBV-BYPYZUCNSA-N

Application

手性原料。


pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

存储类别

10 - Combustible liquids

wgk

WGK 3

flash_point_f

249.8 °F - closed cup

flash_point_c

121 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

法规信息

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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
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
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