Dimorpholinomethane
Basic information
- CAS
5625-90-1- Standard SMILES
C1CN(CN2CCOCC2)CCO1- InChIKey
MIFZZKZNMWTHJK-UHFFFAOYSA-N- Molecular formula
- C9H18N2O2
- Average molar mass
- 186.25 g/mol
- Monoisotopic mass
- 186.13682782
Overview
formaldehyde generator
Names & identifiers
- Preferred name
- Dimorpholinomethane
- IUPAC
- 4-(morpholin-4-ylmethyl)morpholine
- English name
- N,N'-Dimorpholinomethane
- Molecular formula
- C9H18N2O2
- Molecular weight
- 186.25
Names & synonyms
Dimorpholinomethane5625-90-14,4-MethylenedimorpholineMORPHOLINE, 4,4'-METHYLENEDI-7O79DZW79Z4,4-methylene-bismorpholineDTXSID8052859RefChem:506837DTXCID9031270N,N'-Dimorpholinomethane4,4'-Methylenedimorpholine4-(morpholin-4-ylmethyl)morpholine
Show more names
Conncide MWBiocide MBMSIDCHEM LB 69DIMORPHOLINOMETHONEbismorpholinomethaneMethylenedimorpholinebis(morpholino-)methanMORPHOLINE44METHYLENEDI
Morpholine, 4,4'-methylenebis-N,N'-MethylenebismorpholineMFCD000233694-[(morpholin-4-yl)methyl]morpholinebis(4-morpholinyl)methanen,n'-methylene-bis-morpholine4,4'-Methylenebismorpholine4,4'-METHYLENEBIS(MORPHOLINE)
Database identifiers
- CAS
5625-90-1- PubChem CID
- 21839
- DTXSID
DTXSID8052859- UNII
- 7O79DZW79Z
- EC Number
- 227-062-3
- Nikkaji
- J34.695K
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 127
Physicochemical properties
- Boiling point
- 122 · 122-124°C 12mm
- Density
- 1 · 1,04 g/cm3
- refractive index
- 1.479 · 1.4790 (estimate)
- storage temp.
- 2 · 2-8°C
- pka
- 6.91 · 6.91±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Water Solubility
- Soluble in water.
- InChI
- InChI=1S/C9H18N2O2/c1-5-12-6-2-10(1)9-11-3-7-13-8-4-11/h1-9H2
- InChIKey
- MIFZZKZNMWTHJK-UHFFFAOYSA-N
- SMILES
- C(N1CCOCC1)N1CCOCC1
- CAS DataBase Reference
- 5625 · 5625-90-1(CAS DataBase Reference)
- FDA UNII
- 7 O79DZW79Z · 7O79DZW79Z
- EPA Substance Registry System
- 4 · Morpholine, 4,4'-methylenebis- (5625-90-1)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Warning
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P318, P319, P321, P330, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Danger
H302+H312+H332 (10.7%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P203, P260, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P318, P319, P321, P330, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information
Chemical: Morpholine, 4,4'-methylenebis-
Hazard Traits - Carcinogenicity
N,N-Methylenebismorpholine: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Morpholine, 4,4'-methylenebis-: Human health tier II assessment
Hazard Classes and Categories
Acute Tox. 4 (91.9%)
Acute toxicity (ingestion) - category 4
Carc. 1B
Safety data
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS05
- hazard_code
- Xi,F
Chemistry & industry
Applications
UsesIt is employed as intermediate for pharmaceutical.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
3 records
Compound notes
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