[5-(Aminomethyl)-3,4-dimethoxyoxolan-2-yl]methanamine
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Basic information
- CAS
742016-29-1- Standard SMILES
COC1C(CN)OC(CN)C1OC- InChIKey
XJCMNABTDJVRAJ-UHFFFAOYSA-N- Molecular formula
- C8H18N2O3
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.13174244
Names & identifiers
- Preferred name
- [5-(Aminomethyl)-3,4-dimethoxyoxolan-2-yl]methanamine
- IUPAC
- [5-(aminomethyl)-3,4-dimethoxyoxolan-2-yl]methanamine
- English name
- D-Glucitol, 1,6-diamino-2,5-anhydro-1,6-dideoxy-3,4-di-O-methyl- (9CI)
- Molecular formula
- C8H18N2O3
- Molecular weight
- 190.24012
Names & synonyms
D-Glucitol, 1,6-diamino-2,5-anhydro-1,6-dideoxy-3,4-di-O-methyl- (9CI)
Database identifiers
- CAS
742016-29-1- PubChem CID
- 14076921
Properties
Computed structural propertiesFilling in
- XLogP
- -2.1
- Topological polar surface area
- 79.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
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Compound notes
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