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About This Item
Linear Formula:
C6H5C6H9(=O)
CAS Number:
Molecular Weight:
174.24
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
215-888-7
Beilstein/REAXYS Number:
1368883
MDL number:
Assay:
98%
Form:
crystals
assay
98%
form
crystals
mp
56-59 °C (lit.)
SMILES string
O=C1CCCCC1c2ccccc2
InChI
1S/C12H14O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChI key
DRLVMOAWNVOSPE-UHFFFAOYSA-N
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
230.0 °F - closed cup
flash_point_c
110 °C - closed cup
ppe
Eyeshields, Gloves, type N95 (US)
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