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Summary
Name: | diethyl [(1R)-1,5-diaminopentyl]boronate |
Formula: | C9 H23 B N2 O2 |
Formal charge: | 0 |
Formula weight: | 202.102 Da |
Component type: | peptide-like |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | diethyl [(1R)-1,5-diaminopentyl]boronate |
OpenEye OEToolkits | 1.7.0 | (1R)-1-diethoxyboranylpentane-1,5-diamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O(B(OCC)C(N)CCCCN)CC |
SMILES_CANONICAL | CACTVS | 3.370 | CCOB(OCC)[C@@H](N)CCCCN |
SMILES | CACTVS | 3.370 | CCOB(OCC)[CH](N)CCCCN |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | B([C@H](CCCCN)N)(OCC)OCC |
SMILES | OpenEye OEToolkits | 1.7.0 | B(C(CCCCN)N)(OCC)OCC |
InChI | InChI | 1.03 | InChI=1S/C9H23BN2O2/c1-3-13-10(14-4-2)9(12)7-5-6-8-11/h9H,3-8,11-12H2,1-2H3/t9-/m0/s1 |
InChIKey | InChI | 1.03 | FYUGRVWDCBMIQX-VIFPVBQESA-N |