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135782-19-3 molecular structure
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methyl morpholine-2-carboxylate

ChemBase ID: 309077
Molecular Formular: C6H11NO3
Molecular Mass: 145.15644
Monoisotopic Mass: 145.07389322
SMILES and InChIs

SMILES:
C1(C(=O)OC)OCCNC1
Canonical SMILES:
COC(=O)C1CNCCO1
InChI:
InChI=1S/C6H11NO3/c1-9-6(8)5-4-7-2-3-10-5/h5,7H,2-4H2,1H3
InChIKey:
RTITWBGWTASYEG-UHFFFAOYSA-N

Cite this record

CBID:309077 http://www.chembase.cn/molecule-309077.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
methyl morpholine-2-carboxylate
IUPAC Traditional name
methyl morpholine-2-carboxylate
Synonyms
methyl 2-morpholinecarboxylate
CAS Number
135782-19-3
MDL Number
MFCD11656588

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -2.4471653  LogD (pH = 7.4) -0.86873233 
Log P -0.57554525  Molar Refractivity 34.3669 cm3
Polarizability 14.102353 Å3 Polar Surface Area 47.56 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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