AD85796
886779-61-9 | tert-Butyl 3-(tert-butyl)piperazine-1-carboxylate hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AD85796
ChemicalName
tert-Butyl 3-(tert-butyl)piperazine-1-carboxylate hydrochloride
CasNumber
886779-61-9
MolecularFormula
C13H27ClN2O2
MolecularWeight
278.8187
MdlNumber
MFCD18089289
Smiles
O=C(N1CCNC(C1)C(C)(C)C)OC(C)(C)C.Cl
Complexity
276
Covalently-bondedUnitCount
2
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
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CatalogNumber: AD85796
ChemicalName: tert-Butyl 3-(tert-butyl)piperazine-1-carboxylate hydrochloride
CasNumber: 886779-61-9
MolecularFormula: C13H27ClN2O2
MolecularWeight: 278.8187
MdlNumber: MFCD18089289
Smiles: O=C(N1CCNC(C1)C(C)(C)C)OC(C)(C)C.Cl
Complexity: 276
Covalently-bondedUnitCount: 2
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AD85796
ChemicalName:
tert-Butyl 3-(tert-butyl)piperazine-1-carboxylate hydrochloride
CasNumber:
886779-61-9
MolecularFormula:
C13H27ClN2O2
MolecularWeight:
278.8187
MdlNumber:
MFCD18089289
Smiles:
O=C(N1CCNC(C1)C(C)(C)C)OC(C)(C)C.Cl
Complexity:
276
Covalently-bondedUnitCount:
2
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
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Smiles: COc1cc(cc(c1OC)OC)C1NCCN(C1)C(=O)OC(C)(C)C
Complexity: __
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COc1cc(cc(c1OC)OC)C1NCCN(C1)C(=O)OC(C)(C)C
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Smiles: O=C(N1CCNC(C1)c1ccc2c(c1)OCO2)OC(C)(C)C
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Smiles:
O=C(N1CCNC(C1)c1ccc2c(c1)OCO2)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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UndefinedAtomStereocenterCount:
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Smiles: O=C(N1CCNC(C1)c1ccc(cc1)Br)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CCNC(C1)c1ccc(cc1)Br)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__