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1 G
CZK 2,160.00
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1 G
CZK 2,160.00
About This Item
Linear Formula:
CH3CH(OH)CH2CH2OH
CAS Number:
Molecular Weight:
90.12
Beilstein:
1718944
EC Number:
MDL number:
UNSPSC Code:
12352001
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
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.)
functional group
hydroxyl
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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Related Categories
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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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
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