AI63813
94994-39-5 | 4-([(tert-Butoxy)carbonyl](methyl)amino)butanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI63813
ChemicalName
4-([(tert-Butoxy)carbonyl](methyl)amino)butanoic acid
CasNumber
94994-39-5
MolecularFormula
C10H19NO4
MolecularWeight
217.26216000000008
MdlNumber
MFCD09831984
Smiles
CN(C(=O)OC(C)(C)C)CCCC(=O)O
Complexity
232
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
1
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CatalogNumber: AI63813
ChemicalName: 4-([(tert-Butoxy)carbonyl](methyl)amino)butanoic acid
CasNumber: 94994-39-5
MolecularFormula: C10H19NO4
MolecularWeight: 217.26216000000008
MdlNumber: MFCD09831984
Smiles: CN(C(=O)OC(C)(C)C)CCCC(=O)O
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 1
CatalogNumber:
AI63813
ChemicalName:
4-([(tert-Butoxy)carbonyl](methyl)amino)butanoic acid
CasNumber:
94994-39-5
MolecularFormula:
C10H19NO4
MolecularWeight:
217.26216000000008
MdlNumber:
MFCD09831984
Smiles:
CN(C(=O)OC(C)(C)C)CCCC(=O)O
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc2c(c1)n(c1ccccc1)c1c2cccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc2c(c1)n(c1ccccc1)c1c2cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI63815
ChemicalName: 4-Amino-5-aminomethyl-2-methylpyrimidine
CasNumber: 95-02-3
MolecularFormula: C6H10N4
MolecularWeight: 138.1704
MdlNumber: MFCD00078880
Smiles: NCc1cnc(nc1N)C
Complexity: 106
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.3
CatalogNumber:
AI63815
ChemicalName:
4-Amino-5-aminomethyl-2-methylpyrimidine
CasNumber:
95-02-3
MolecularFormula:
C6H10N4
MolecularWeight:
138.1704
MdlNumber:
MFCD00078880
Smiles:
NCc1cnc(nc1N)C
Complexity:
106
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.3
CatalogNumber: AI63816
ChemicalName: 2-Methylbenzoxazole
CasNumber: 95-21-6
MolecularFormula: C8H7NO
MolecularWeight: 133.1473
MdlNumber: MFCD00005771
Smiles: CC1=NC2=CC=CC=C2O1
Complexity: 126
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.2
CatalogNumber:
AI63816
ChemicalName:
2-Methylbenzoxazole
CasNumber:
95-21-6
MolecularFormula:
C8H7NO
MolecularWeight:
133.1473
MdlNumber:
MFCD00005771
Smiles:
CC1=NC2=CC=CC=C2O1
Complexity:
126
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.2