AF30638
22649-28-1 | 2H-Chromene-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AF30638
ChemicalName
2H-Chromene-3-carboxylic acid
CasNumber
22649-28-1
MolecularFormula
C10H8O3
MolecularWeight
176.1687
MdlNumber
MFCD00202020
Smiles
OC(=O)C1=Cc2c(OC1)cccc2
NscNumber
279235
Complexity
245
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AF30638
ChemicalName: 2H-Chromene-3-carboxylic acid
CasNumber: 22649-28-1
MolecularFormula: C10H8O3
MolecularWeight: 176.1687
MdlNumber: MFCD00202020
Smiles: OC(=O)C1=Cc2c(OC1)cccc2
NscNumber: 279235
Complexity: 245
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AF30638
ChemicalName:
2H-Chromene-3-carboxylic acid
CasNumber:
22649-28-1
MolecularFormula:
C10H8O3
MolecularWeight:
176.1687
MdlNumber:
MFCD00202020
Smiles:
OC(=O)C1=Cc2c(OC1)cccc2
NscNumber:
279235
Complexity:
245
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.5
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Smiles: CN[C@H]1CCCC[C@@H]1O
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Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
CN[C@H]1CCCC[C@@H]1O
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HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C1COc2c(N1)cc(cc2)C(=O)C(Cl)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1COc2c(N1)cc(cc2)C(=O)C(Cl)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__