AB27792
2517-04-6 | Azetidine-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB27792
ChemicalName
Azetidine-2-carboxylic acid
CasNumber
2517-04-6
MolecularFormula
C4H7NO2
MolecularWeight
101.10387999999999
MdlNumber
MFCD00066660
Smiles
OC(=O)C1CCN1
NscNumber
72471
Complexity
91.7
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
-2.9
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CatalogNumber: AB27792
ChemicalName: Azetidine-2-carboxylic acid
CasNumber: 2517-04-6
MolecularFormula: C4H7NO2
MolecularWeight: 101.10387999999999
MdlNumber: MFCD00066660
Smiles: OC(=O)C1CCN1
NscNumber: 72471
Complexity: 91.7
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: -2.9
CatalogNumber:
AB27792
ChemicalName:
Azetidine-2-carboxylic acid
CasNumber:
2517-04-6
MolecularFormula:
C4H7NO2
MolecularWeight:
101.10387999999999
MdlNumber:
MFCD00066660
Smiles:
OC(=O)C1CCN1
NscNumber:
72471
Complexity:
91.7
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
-2.9
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Smiles: CC(C(=O)[O-])C.[Li+]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
CC(C(=O)[O-])C.[Li+]
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Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(c1ccccc1O)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(c1ccccc1O)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1C(O)N=C(c2c(N1C)cccc2)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1C(O)N=C(c2c(N1C)cccc2)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__