AB75679
5597-50-2 | Methyl 3-(4-hydroxyphenyl)propanoate
Manufacturer: A2B Chem
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CatalogNumber
AB75679
ChemicalName
Methyl 3-(4-hydroxyphenyl)propanoate
CasNumber
5597-50-2
MolecularFormula
C10H12O3
MolecularWeight
180.20048
MdlNumber
MFCD00071577
Smiles
COC(=O)CCc1ccc(cc1)O
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2
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CatalogNumber: AB75679
ChemicalName: Methyl 3-(4-hydroxyphenyl)propanoate
CasNumber: 5597-50-2
MolecularFormula: C10H12O3
MolecularWeight: 180.20048
MdlNumber: MFCD00071577
Smiles: COC(=O)CCc1ccc(cc1)O
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2
CatalogNumber:
AB75679
ChemicalName:
Methyl 3-(4-hydroxyphenyl)propanoate
CasNumber:
5597-50-2
MolecularFormula:
C10H12O3
MolecularWeight:
180.20048
MdlNumber:
MFCD00071577
Smiles:
COC(=O)CCc1ccc(cc1)O
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CCc1ccc(cc1)I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CCc1ccc(cc1)I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cccc(c1)N1CCN(CC1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cccc(c1)N1CCN(CC1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB75682
ChemicalName: Methyl 3-oxo-3-(pyridin-4-yl)propanoate
CasNumber: 829-45-8
MolecularFormula: C9H9NO3
MolecularWeight: 179.17265999999998
MdlNumber: MFCD00466380
Smiles: COC(=O)CC(=O)c1ccncc1
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 0.6
CatalogNumber:
AB75682
ChemicalName:
Methyl 3-oxo-3-(pyridin-4-yl)propanoate
CasNumber:
829-45-8
MolecularFormula:
C9H9NO3
MolecularWeight:
179.17265999999998
MdlNumber:
MFCD00466380
Smiles:
COC(=O)CC(=O)c1ccncc1
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
0.6