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Carbonic acid, butyl ethyl ester

HCID 61880
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Basic information

CAS
30714-78-4
Standard SMILES
CCCCOC(=O)OCC
InChIKey
DISYGAAFCMVRKW-UHFFFAOYSA-N
Molecular formula
C7H14O3
Average molar mass
146.18 g/mol
Monoisotopic mass
146.0942943

Names & identifiers

Preferred name
Carbonic acid, butyl ethyl ester
IUPAC
butyl ethyl carbonate
English name
Carbonic acid butyl(ethyl) ester
Molecular formula
C7H14O3
Molecular weight
146.18

Names & synonyms

Ethyl butyl carbonateCarbonic acid, butyl ethyl esterDTXSID70184740NSC 122766RefChem:123592DTXCID10107231DISYGAAFCMVRKW-UHFFFAOYSA-Nbutyl ethyl carbonate30714-78-4carbonic acid butyl ethyl esterNSC-1227668HT7BK4WN7
Show more names
Carbonic acid butyl(ethyl) ester
SCHEMBL137933SCHEMBL444270SCHEMBL449195SCHEMBL696985SCHEMBL2900732SCHEMBL16698777NSC122766

Database identifiers

CAS
30714-78-4
PubChem CID
61880
DTXSID
DTXSID70184740
UNII
8HT7BK4WN7
Nikkaji
J191.545B

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
10
Formal charge
0
Complexity
90.9

Experimental & physicochemical properties

SpringerMaterials PropertiesSurface tension

Physicochemical properties

Boiling point
168.5 °C · 168.5 °C(Press: 748 Torr)
Density
0.949 · 0.949±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers1 total

上海宝杨宝欣生物科技有限公司021-56698539 19921169802 · [email protected]

Related reactions

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Compound notes

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