AG21689
498532-32-4 | (1R,3S)-Cyclohexane-1,3-diamine dihydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AG21689
ChemicalName
(1R,3S)-Cyclohexane-1,3-diamine dihydrochloride
CasNumber
498532-32-4
MolecularFormula
C6H16Cl2N2
MolecularWeight
187.1106
MdlNumber
MFCD01667588
Smiles
N[C@@H]1CCC[C@@H](C1)N.Cl.Cl
Complexity
64.9
Covalently-bondedUnitCount
3
DefinedAtomStereocenterCount
2
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
4
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CatalogNumber: AG21689
ChemicalName: (1R,3S)-Cyclohexane-1,3-diamine dihydrochloride
CasNumber: 498532-32-4
MolecularFormula: C6H16Cl2N2
MolecularWeight: 187.1106
MdlNumber: MFCD01667588
Smiles: N[C@@H]1CCC[C@@H](C1)N.Cl.Cl
Complexity: 64.9
Covalently-bondedUnitCount: 3
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 4
CatalogNumber:
AG21689
ChemicalName:
(1R,3S)-Cyclohexane-1,3-diamine dihydrochloride
CasNumber:
498532-32-4
MolecularFormula:
C6H16Cl2N2
MolecularWeight:
187.1106
MdlNumber:
MFCD01667588
Smiles:
N[C@@H]1CCC[C@@H](C1)N.Cl.Cl
Complexity:
64.9
Covalently-bondedUnitCount:
3
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: COC(=O)/C(=C/C(=O)OC)/Nc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
COC(=O)/C(=C/C(=O)OC)/Nc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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Smiles: CCOC(=O)c1c(O)c2ccccc2n(c1=O)CC
Complexity: __
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DefinedAtomStereocenterCount: __
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Smiles:
CCOC(=O)c1c(O)c2ccccc2n(c1=O)CC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Smiles: CCOC(=O)C(CN)(F)F
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(CN)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__