AB58159
6914-74-5 | 1-Carbamoylcyclopropanecarboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB58159
ChemicalName
1-Carbamoylcyclopropanecarboxylic acid
CasNumber
6914-74-5
MolecularFormula
C5H7NO3
MolecularWeight
129.114
MdlNumber
MFCD00190650
Smiles
NC(=O)C1(CC1)C(=O)O
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
-0.8
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CatalogNumber: AB58159
ChemicalName: 1-Carbamoylcyclopropanecarboxylic acid
CasNumber: 6914-74-5
MolecularFormula: C5H7NO3
MolecularWeight: 129.114
MdlNumber: MFCD00190650
Smiles: NC(=O)C1(CC1)C(=O)O
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.8
CatalogNumber:
AB58159
ChemicalName:
1-Carbamoylcyclopropanecarboxylic acid
CasNumber:
6914-74-5
MolecularFormula:
C5H7NO3
MolecularWeight:
129.114
MdlNumber:
MFCD00190650
Smiles:
NC(=O)C1(CC1)C(=O)O
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.8
CatalogNumber: __
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MolecularFormula: __
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Smiles: F[B-](F)(F)F.CCOC(=O)C1(CC1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
F[B-](F)(F)F.CCOC(=O)C1(CC1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=C(N1CCCC1(C)C(=O)O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=C(N1CCCC1(C)C(=O)O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: BrCC1CCCN(C1)C(=O)OCc1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
BrCC1CCCN(C1)C(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__