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6105-75-5 molecular structure
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2-methyl-1-(morpholin-4-yl)propan-2-amine

ChemBase ID: 17030
Molecular Formular: C8H18N2O
Molecular Mass: 158.24132
Monoisotopic Mass: 158.14191321
SMILES and InChIs

SMILES:
N1(CC(N)(C)C)CCOCC1
Canonical SMILES:
CC(CN1CCOCC1)(N)C
InChI:
InChI=1S/C8H18N2O/c1-8(2,9)7-10-3-5-11-6-4-10/h3-7,9H2,1-2H3
InChIKey:
JCXYZQUYVNLCTG-UHFFFAOYSA-N

Cite this record

CBID:17030 http://www.chembase.cn/molecule-17030.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-methyl-1-(morpholin-4-yl)propan-2-amine
IUPAC Traditional name
2-methyl-1-(morpholin-4-yl)propan-2-amine
Synonyms
1,1-Dimethyl-2-morpholin-4-yl-ethylamine
1,1-Dimethyl-2-morpholinoethylamine
4-(2-Amino-2-methyl)propylmorpholine 97%
2-Methyl-1-morpholinopropan-2-amine
2-methyl-1-morpholino-2-propanamine
(1,1-dimethyl-2-morpholin-4-ylethyl)amine
CAS Number
6105-75-5
MDL Number
MFCD01714129
PubChem SID
160980337
PubChem CID
201497

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.6143422  LogD (pH = 7.4) -2.4861557 
Log P -0.1281631  Molar Refractivity 46.0694 cm3
Polarizability 18.481222 Å3 Polar Surface Area 38.49 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
Storage Warning
Corrosive/Air Sensitive/Store under Argon expand Show data source
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false expand Show data source
Purity
95+% expand Show data source
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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