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C86006

Crotyl alcohol, mixture of cis and trans

96%

Synonym(s):

2-Buten-1-ol

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About This Item

Linear Formula:
CH3CH=CHCH2OH
CAS Number:
6117-91-5
Molecular Weight:
72.11
NACRES:
NA.22
UNSPSC Code:
12352100
PubChem Substance ID:
24893079
EC Number:
228-086-7
Beilstein/REAXYS Number:
1361395
MDL number:
MFCD00002923
Assay:
96%
Form:
liquid
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Quality Segment

200

assay

96%

form

liquid

refractive index

n20/D 1.427 (lit.)

bp

121-122 °C (lit.)

density

0.845 g/mL at 25 °C (lit.)

functional group

hydroxyl

SMILES string

C\C=C\CO

InChI

1S/C4H8O/c1-2-3-4-5/h2-3,5H,4H2,1H3/b3-2+

InChI key

WCASXYBKJHWFMY-NSCUHMNNSA-N

Application

Crotyl alcohol can be used as a starting material in the synthesis of antitumor agents such as 14-azacamptothecin and 10, 11-methylenedioxy-14-azacamptothecin. It can also be used as a precursor in the total synthesis of discodermolide.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

93.2 °F - closed cup

flash_point_c

34 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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