AF06365
1878-61-1 | 3-(Carboxymethoxy)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF06365
ChemicalName
3-(Carboxymethoxy)benzoic acid
CasNumber
1878-61-1
MolecularFormula
C9H8O5
MolecularWeight
196.15682
MdlNumber
MFCD09259431
Smiles
OC(=O)COc1cccc(c1)C(=O)O
Complexity
225
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
1.1
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CatalogNumber: AF06365
ChemicalName: 3-(Carboxymethoxy)benzoic acid
CasNumber: 1878-61-1
MolecularFormula: C9H8O5
MolecularWeight: 196.15682
MdlNumber: MFCD09259431
Smiles: OC(=O)COc1cccc(c1)C(=O)O
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.1
CatalogNumber:
AF06365
ChemicalName:
3-(Carboxymethoxy)benzoic acid
CasNumber:
1878-61-1
MolecularFormula:
C9H8O5
MolecularWeight:
196.15682
MdlNumber:
MFCD09259431
Smiles:
OC(=O)COc1cccc(c1)C(=O)O
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.1
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Smiles: CC(OC(=O)c1cc(O)ccc1O)C
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Smiles:
CC(OC(=O)c1cc(O)ccc1O)C
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Brc1ccc(c(c1)C(=O)Cl)O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(c(c1)C(=O)Cl)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__