AB47693
924-49-2 | Dl-4-amino-3-hydroxybutyric acid
Manufacturer: A2B Chem
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CatalogNumber
AB47693
ChemicalName
Dl-4-amino-3-hydroxybutyric acid
CasNumber
924-49-2
MolecularFormula
C4H9NO3
MolecularWeight
119.1192
MdlNumber
MFCD00008141
Smiles
NCC(CC(=O)O)O
Complexity
83.4
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
-4.1
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CatalogNumber: AB47693
ChemicalName: Dl-4-amino-3-hydroxybutyric acid
CasNumber: 924-49-2
MolecularFormula: C4H9NO3
MolecularWeight: 119.1192
MdlNumber: MFCD00008141
Smiles: NCC(CC(=O)O)O
Complexity: 83.4
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: -4.1
CatalogNumber:
AB47693
ChemicalName:
Dl-4-amino-3-hydroxybutyric acid
CasNumber:
924-49-2
MolecularFormula:
C4H9NO3
MolecularWeight:
119.1192
MdlNumber:
MFCD00008141
Smiles:
NCC(CC(=O)O)O
Complexity:
83.4
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
-4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCc1cnc(cn1)C
Complexity: 83
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCc1cnc(cn1)C
Complexity:
83
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1
CatalogNumber: AB47695
ChemicalName: Methyl 1-bromocyclopropanecarboxylate
CasNumber: 96999-01-8
MolecularFormula: C5H7BrO2
MolecularWeight: 179.0119
MdlNumber: MFCD12922645
Smiles: COC(=O)C1(Br)CC1
Complexity: 118
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 1.3
CatalogNumber:
AB47695
ChemicalName:
Methyl 1-bromocyclopropanecarboxylate
CasNumber:
96999-01-8
MolecularFormula:
C5H7BrO2
MolecularWeight:
179.0119
MdlNumber:
MFCD12922645
Smiles:
COC(=O)C1(Br)CC1
Complexity:
118
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCCCCC(=O)[O-].[K+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCCCCC(=O)[O-].[K+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__