AB00094
177545-89-0 | trans-4-(BOC-amino)cyclohexyl mesylate
Manufacturer: A2B Chem
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CatalogNumber
AB00094
ChemicalName
trans-4-(BOC-amino)cyclohexyl mesylate
CasNumber
177545-89-0
MolecularFormula
C12H23NO5S
MolecularWeight
293.3797
MdlNumber
MFCD09991636
Smiles
O=C(OC(C)(C)C)N[C@@H]1CC[C@H](CC1)OS(=O)(=O)C
Complexity
399
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
1.7
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CatalogNumber: AB00094
ChemicalName: trans-4-(BOC-amino)cyclohexyl mesylate
CasNumber: 177545-89-0
MolecularFormula: C12H23NO5S
MolecularWeight: 293.3797
MdlNumber: MFCD09991636
Smiles: O=C(OC(C)(C)C)N[C@@H]1CC[C@H](CC1)OS(=O)(=O)C
Complexity: 399
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 1.7
CatalogNumber:
AB00094
ChemicalName:
trans-4-(BOC-amino)cyclohexyl mesylate
CasNumber:
177545-89-0
MolecularFormula:
C12H23NO5S
MolecularWeight:
293.3797
MdlNumber:
MFCD09991636
Smiles:
O=C(OC(C)(C)C)N[C@@H]1CC[C@H](CC1)OS(=O)(=O)C
Complexity:
399
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: FC(C1=NCCNC=C1)(F)F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularWeight:
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Smiles:
FC(C1=NCCNC=C1)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: C=COC(=O)CCCCCC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
C=COC(=O)CCCCCC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: ClCC(=O)NCCC#N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCC(=O)NCCC#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__