3-Azahexanedial, 3-methyl-, tetraethylacetal

HCID 59658

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Basic information

CAS: 102585-85-3
Standard SMILES: CCOC(CCN(C)CC(OCC)OCC)OCC
InChIKey: ZJJNMWZALMAMCH-UHFFFAOYSA-N
Molecular formula: C14H31NO4
Average molar mass: 277.4 g/mol
Monoisotopic mass: 277.22530847

Names & identifiers

Preferred name: 3-Azahexanedial, 3-methyl-, tetraethylacetal
IUPAC: N-(2,2-diethoxyethyl)-3,3-diethoxy-N-methylpropan-1-amine

Names & synonyms

102585-85-33-Methyl-3-azahexanedial tetraethylacetal3-AZAHEXANEDIAL, 3-METHYL-, TETRAETHYLACETAL3-Azaadipaldehyde, 3-methyl-, tetraethylacetal3-Azaadipaldehyde, 3-methyl-, bis(diethylacetal)DTXSID30145332RefChem:276788DTXCID7067823N-(2,2-diethoxyethyl)-3,3-diethoxy-N-methylpropan-1-amine1-Propanamine, N-(2,2-diethoxyethyl)-3,3-diethoxy-N-methyl-

Database identifiers

CAS: 102585-85-3
PubChem CID: 59658
DTXSID: DTXSID30145332
Nikkaji: J84.621J

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 40.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 13
Heavy atoms: 19
Formal charge: 0
Complexity: 180

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