N-Methylmorpholine

C₅H₁₁NOCAS 109-02-4101.15 g/mol

Open in Covalent MOL file

Ether Tertiary amine

Properties

Molecular formula: C₅H₁₁NO
Molar mass: 101.15 g/mol
Exact mass: 101.0841 Da
Density: 0.9141 g/mL (at 25 °C)
Melting point: 146–147 °C
Boiling point: 116 °C
pKa: 7.4
Flash point: 23.9 °C
logP: -0.05Crippen estimate
Polar surface area: 12.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Danger

H225 Highly Flammable liquid and vapor89.1% of notifiers
H302 Harmful if swallowed94.5% of notifiers
H312 Harmful in contact with skin55.4% of notifiers
H314 Causes severe skin burns and eye damage98% of notifiers
H318 Causes serious eye damage40.3% of notifiers
H332 Harmful if inhaled38.7% of notifiers

Aggregated from 715 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

109-02-4

SMILES

CN1CCOCC1

InChIKey

SJRJJKPEHAURKC-UHFFFAOYSA-N

InChI

InChI=1S/C5H11NO/c1-6-2-4-7-5-3-6/h2-5H2,1H3

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Type any one amount. The others follow from the molar mass and density.

Names and synonyms

7 names

Morpholine, 4-methyl-
4-Methylmorpholine
1-Methylmorpholine
NMM
NSC 9382
KL 21
Jeffcat NMM

Work with N-Methylmorpholine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Bis(dimethylaminoethyl) ether3033-62-356 % similar 1,4-Dimethylpiperazine106-58-153 % similar 1-Methylpyrrolidine120-94-547 % similar Dimorpholinodiethyl ether6425-39-447 % similar N-(2-Dimethylaminoethyl)morpholine4385-05-145 % similar 2.2.2-Cryptand23978-09-844 % similar 1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane41203-22-944 % similar N-Methylpiperidine626-67-544 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(S)-(+)-1-Methyl-3-pyrrolidinol104641-59-0 (3R)-1-Methyl-3-pyrrolidinol104641-60-3 (3R)-Tetrahydro-3-furanmethanamine1048962-82-8 (3S)-Tetrahydro-3-furanmethanamine1048962-84-0 D-Beta-Prolinol110013-18-8 (3S)-3-Pyrrolidinemethanol110013-19-9 Oxan-3-amine120811-32-7 1-Methyl-3-pyrrolidinol13220-33-2

Elsewhere

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