3-Ethylindolin-2-one

HCID 347325
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Basic information

CAS
15379-45-0
Standard SMILES
CCC1C(=O)Nc2ccccc21
InChIKey
IPHNYSQCMZUVDY-UHFFFAOYSA-N
Molecular formula
C10H11NO
Average molar mass
161.2 g/mol
Monoisotopic mass
161.08406397

Names & identifiers

Preferred name
3-Ethylindolin-2-one
IUPAC
3-ethyl-1,3-dihydroindol-2-one
English name
1,3-dihydro-3-ethyl-2H-indol-2-one
Molecular formula
C10H11NO
Molecular weight
161.2

Names & synonyms

3-ETHYLINDOLIN-2-ONE15379-45-03-ethyl-1,3-dihydroindol-2-one3-ethyloxindole3-ethyl-1,3-dihydro-2H-indol-2-one3-ethyl-2,3-dihydro-1H-indol-2-one1,3-Dihydro-3-ethyl-2H-indol-2-one3-ethyl-1,3-dihydro-indol-2-oneMFCD11707091NSC405958SCHEMBL2693278SCHEMBL5534588
Show more names
RS RMA044302H-Indol-2-one, 3-ethyl-1,3-dihydro-
SCHEMBL9159527SCHEMBL9586633SCHEMBL20416076DTXSID00324172IPHNYSQCMZUVDY-UHFFFAOYSA-NQAA37945AKOS006346324NSC-405958

Database identifiers

CAS
15379-45-0
PubChem CID
347325
DTXSID
DTXSID00324172
Nikkaji
J416.482B

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
12

Physicochemical properties

Melting point
250 °C · 250 °C
Boiling point
292.7 · 292.7±29.0 °C(Predicted)
Density
1.084 · 1.084±0.06 g/cm3(Predicted)
pka
14.81 · 14.81±0.40(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers7 total

湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海技毅生物科技有限公司13621943973 · [email protected]
南京博济达医药科技有限公司18762407961 · [email protected]

Related reactions

13 records
New reaction record

Compound notes

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