AA15786
1163729-53-0 | tert-Butyl 1-(aminomethyl)-6-azaspiro[2.5]octane-6-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA15786
ChemicalName
tert-Butyl 1-(aminomethyl)-6-azaspiro[2.5]octane-6-carboxylate
CasNumber
1163729-53-0
MolecularFormula
C13H24N2O2
MolecularWeight
240.3419
MdlNumber
MFCD12546358
Smiles
NCC1CC21CCN(CC2)C(=O)OC(C)(C)C
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
1.2
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CatalogNumber: AA15786
ChemicalName: tert-Butyl 1-(aminomethyl)-6-azaspiro[2.5]octane-6-carboxylate
CasNumber: 1163729-53-0
MolecularFormula: C13H24N2O2
MolecularWeight: 240.3419
MdlNumber: MFCD12546358
Smiles: NCC1CC21CCN(CC2)C(=O)OC(C)(C)C
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.2
CatalogNumber:
AA15786
ChemicalName:
tert-Butyl 1-(aminomethyl)-6-azaspiro[2.5]octane-6-carboxylate
CasNumber:
1163729-53-0
MolecularFormula:
C13H24N2O2
MolecularWeight:
240.3419
MdlNumber:
MFCD12546358
Smiles:
NCC1CC21CCN(CC2)C(=O)OC(C)(C)C
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CC(C1)(O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CC(C1)(O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CCC(CC1)(O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CCC(CC1)(O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AA15800
ChemicalName: 3-Amino-5-carboxylphenylboronic acid
CasNumber: 116378-40-6
MolecularFormula: C7H8BNO4
MolecularWeight: 180.9537
MdlNumber: MFCD02179466
Smiles: Nc1cc(cc(c1)C(=O)O)B(O)O
Complexity: 199
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 4
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AA15800
ChemicalName:
3-Amino-5-carboxylphenylboronic acid
CasNumber:
116378-40-6
MolecularFormula:
C7H8BNO4
MolecularWeight:
180.9537
MdlNumber:
MFCD02179466
Smiles:
Nc1cc(cc(c1)C(=O)O)B(O)O
Complexity:
199
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
4
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
__