Home > Compound List > Compound details
87439-10-9 molecular structure
click picture or here to close

2-methyl-2-(morpholin-4-yl)propanoic acid

ChemBase ID: 308005
Molecular Formular: C8H15NO3
Molecular Mass: 173.2096
Monoisotopic Mass: 173.10519335
SMILES and InChIs

SMILES:
C(N1CCOCC1)(C(=O)O)(C)C
Canonical SMILES:
OC(=O)C(N1CCOCC1)(C)C
InChI:
InChI=1S/C8H15NO3/c1-8(2,7(10)11)9-3-5-12-6-4-9/h3-6H2,1-2H3,(H,10,11)
InChIKey:
ZIYBQIQKOLIMKY-UHFFFAOYSA-N

Cite this record

CBID:308005 http://www.chembase.cn/molecule-308005.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-methyl-2-(morpholin-4-yl)propanoic acid
IUPAC Traditional name
2-methyl-2-(morpholin-4-yl)propanoic acid
Synonyms
2-methyl-2-(4-morpholinyl)propanoic acid
CAS Number
87439-10-9
MDL Number
MFCD05230906

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 4026853 external link Add to cart
Data Source Data ID Price
ChemBridge
4026853 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.9505146  LogD (pH = 7.4) -2.4198115 
Log P -1.9454272  Molar Refractivity 44.3544 cm3
Polarizability 17.513292 Å3 Polar Surface Area 49.77 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle