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Ethyl [2-[[(2-hydroxyethyl)amino]carbonyl]phenyl]carbamate

HCID 71039
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Basic information

CAS
1218-72-0
Standard SMILES
CCOC(=O)Nc1ccccc1C(=O)NCCO
InChIKey
BHYOHZBTLABFEJ-UHFFFAOYSA-N
Molecular formula
C12H16N2O4
Average molar mass
252.27 g/mol
Monoisotopic mass
252.111007

Names & identifiers

Preferred name
Ethyl [2-[[(2-hydroxyethyl)amino]carbonyl]phenyl]carbamate
IUPAC
ethyl N-[2-(2-hydroxyethylcarbamoyl)phenyl]carbamate
English name
ethyl [2-[[(2-hydroxyethyl)amino]carbonyl]phenyl]carbamate
Molecular formula
C12H16N2O4
Molecular weight
252.27

Names & synonyms

1218-72-0ETHYL [2-[[(2-HYDROXYETHYL)AMINO]CARBONYL]PHENYL]CARBAMATEEthyl (2-(((2-hydroxyethyl)amino)carbonyl)phenyl)carbamateBHYOHZBTLABFEJ-UHFFFAOYSA-NEINECS 214-939-0ethyl N-[2-(2-hydroxyethylcarbamoyl)phenyl]carbamateDTXSID00923962NS000453882-{[Ethoxy(hydroxy)methylidene]amino}-N-(2-hydroxyethyl)benzene-1-carboximidic acidN-[2-[[(2-Hydroxyethyl)amino]carbonyl]phenyl]carbamic acid ethyl esterCarbamic acid, N-[2-[[(2-hydroxyethyl)amino]carbonyl]phenyl]-, ethyl ester

Database identifiers

CAS
1218-72-0
PubChem CID
71039
DTXSID
DTXSID00923962
EC Number
214-939-0
Nikkaji
J217.068J

Properties

Computed structural properties

XLogP
1
Topological polar surface area
87.7 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
18
Formal charge
0
Complexity
283

Physicochemical properties

Melting point
104 · 104-107 °C
Boiling point
420.3 · 420.3±30.0 °C(Predicted)
Density
1.262 · 1.262±0.06 g/cm3(Predicted)
pka
13.33 · 13.33±0.70(Predicted)

Chemistry & industry

Suppliers1 total

陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]

Related reactions

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Compound notes

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