AB49490
22744-12-3 | 2-(4-(Methoxycarbonyl)phenyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB49490
ChemicalName
2-(4-(Methoxycarbonyl)phenyl)acetic acid
CasNumber
22744-12-3
MolecularFormula
C10H10O4
MolecularWeight
194.184
MdlNumber
MFCD19440718
Smiles
COC(=O)c1ccc(cc1)CC(=O)O
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.8
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CatalogNumber: AB49490
ChemicalName: 2-(4-(Methoxycarbonyl)phenyl)acetic acid
CasNumber: 22744-12-3
MolecularFormula: C10H10O4
MolecularWeight: 194.184
MdlNumber: MFCD19440718
Smiles: COC(=O)c1ccc(cc1)CC(=O)O
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.8
CatalogNumber:
AB49490
ChemicalName:
2-(4-(Methoxycarbonyl)phenyl)acetic acid
CasNumber:
22744-12-3
MolecularFormula:
C10H10O4
MolecularWeight:
194.184
MdlNumber:
MFCD19440718
Smiles:
COC(=O)c1ccc(cc1)CC(=O)O
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClS(=O)(=O)c1ccc2c(c1)cn[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClS(=O)(=O)c1ccc2c(c1)cn[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB49492
ChemicalName: 1H-Pyrazole-3-carbaldehyde
CasNumber: 3920-50-1
MolecularFormula: C4H4N2O
MolecularWeight: 96.0874
MdlNumber: MFCD00129925
Smiles: O=Cc1cc[nH]n1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB49492
ChemicalName:
1H-Pyrazole-3-carbaldehyde
CasNumber:
3920-50-1
MolecularFormula:
C4H4N2O
MolecularWeight:
96.0874
MdlNumber:
MFCD00129925
Smiles:
O=Cc1cc[nH]n1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)[C@@H](O[C@H]1C[C@H](N)[C@@H]([C@@H](O1)C)O)C[C@](C2)(O)C(=O)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cccc2c1C(=O)c1c(C2=O)c(O)c2c(c1O)[C@@H](O[C@H]1C[C@H](N)[C@@H]([C@@H](O1)C)O)C[C@](C2)(O)C(=O)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__