AB50774
674792-05-3 | (S)-1-Boc-2-isopropyl-piperazine
Manufacturer: A2B Chem
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CatalogNumber
AB50774
ChemicalName
(S)-1-Boc-2-isopropyl-piperazine
CasNumber
674792-05-3
MolecularFormula
C12H24N2O2
MolecularWeight
228.3312
MdlNumber
MFCD03787918
Smiles
CC([C@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity
246
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.9
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CatalogNumber: AB50774
ChemicalName: (S)-1-Boc-2-isopropyl-piperazine
CasNumber: 674792-05-3
MolecularFormula: C12H24N2O2
MolecularWeight: 228.3312
MdlNumber: MFCD03787918
Smiles: CC([C@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity: 246
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AB50774
ChemicalName:
(S)-1-Boc-2-isopropyl-piperazine
CasNumber:
674792-05-3
MolecularFormula:
C12H24N2O2
MolecularWeight:
228.3312
MdlNumber:
MFCD03787918
Smiles:
CC([C@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity:
246
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)[nH]c1c2cccc1
Complexity: 231
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)[nH]c1c2cccc1
Complexity:
231
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.8
CatalogNumber: AB50776
ChemicalName: 1,4-Dioxa-spiro[4,5]dec-7-en-8-boronic acid, pinacol ester
CasNumber: 680596-79-6
MolecularFormula: C14H23BO4
MolecularWeight: 266.141
MdlNumber: MFCD04115656
Smiles: CC1(C)OB(OC1(C)C)C1=CCC2(CC1)OCCO2
Complexity: 380
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB50776
ChemicalName:
1,4-Dioxa-spiro[4,5]dec-7-en-8-boronic acid, pinacol ester
CasNumber:
680596-79-6
MolecularFormula:
C14H23BO4
MolecularWeight:
266.141
MdlNumber:
MFCD04115656
Smiles:
CC1(C)OB(OC1(C)C)C1=CCC2(CC1)OCCO2
Complexity:
380
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCc1cccc(c1)I
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCc1cccc(c1)I
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__