Dibutyl Carbonate

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Catalog Number
ACM542529
Product Name
Dibutyl Carbonate
Structure
Structure
CAS
542-52-9
Category
Heterocyclic Organic Compound
Synonyms
Carbonic Acid Dibutyl Ester
IUPAC Name
dibutyl carbonate
Molecular Weight
174.24
Molecular Formula
C9H18O3
Canonical SMILES
CCCCOC(=O)OCCCC
InChI
InChI=1S/C9H18O3/c1-3-5-7-11-9(10)12-8-6-4-2/h3-8H2,1-2H3
InChI Key
QLVWOKQMDLQXNN-UHFFFAOYSA-N
Boiling Point
207 °C
Flash Point
76 °C
Appearance
Colorless to Almost colorless clear liquid
Storage
Store under inert gas
Complexity
100
Condition To Avoid
Moisture Sensitive
Covalently-Bonded Unit Count
1
EC Number
208-816-0
Exact Mass
174.125594g/mol
Formal Charge
0
Hazard Statements
H227 : Combustible liquid.
H-Bond Acceptor
3
H-Bond Donor
0
Heavy Atom Count
12
MDL Number
MFCD00043938
Monoisotopic Mass
174.125594g/mol
NSC Number
8462
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P210 : Keep away from heat/sparks/open flames/hot surfaces. No smoking.P280 : Wear protective gloves/ eye protection/ face protection.P370 + P378 : In case of fire: Use dry sand, dry chemical or alcohol-resistant foam to extinguish.P403 + P235 : Store in a well-ventilated place. Keep cool.
Refractive Index
1.41
Rotatable Bond Count
8
Signal Word
Warning
SpecificGravity
0.93
UNII
62WFZ7P7QB
XLogP3
3
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