AB38940
3025-95-4 | N-Acetyl-beta-Alanine
Manufacturer: A2B Chem
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CatalogNumber
AB38940
ChemicalName
N-Acetyl-beta-Alanine
CasNumber
3025-95-4
MolecularFormula
C5H9NO3
MolecularWeight
131.1299
MdlNumber
MFCD00037296
Smiles
OC(=O)CCNC(=O)C
NscNumber
32039
Complexity
121
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
-1
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CatalogNumber: AB38940
ChemicalName: N-Acetyl-beta-Alanine
CasNumber: 3025-95-4
MolecularFormula: C5H9NO3
MolecularWeight: 131.1299
MdlNumber: MFCD00037296
Smiles: OC(=O)CCNC(=O)C
NscNumber: 32039
Complexity: 121
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -1
CatalogNumber:
AB38940
ChemicalName:
N-Acetyl-beta-Alanine
CasNumber:
3025-95-4
MolecularFormula:
C5H9NO3
MolecularWeight:
131.1299
MdlNumber:
MFCD00037296
Smiles:
OC(=O)CCNC(=O)C
NscNumber:
32039
Complexity:
121
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc2c(c1N=Nc1ccc(cc1)[N+](=O)[O-])cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Nc1ccc2c(c1N=Nc1ccc(cc1)[N+](=O)[O-])cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN(c1ccc(cc1)N=Nc1ccc(cc1)[N+](=O)[O-])CC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN(c1ccc(cc1)N=Nc1ccc(cc1)[N+](=O)[O-])CC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC=CC=CC(=O)OCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCC=CC=CC(=O)OCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__