AA64812
14657-64-8 | 3-Hydroxyphenylphosphinyl-propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA64812
ChemicalName
3-Hydroxyphenylphosphinyl-propanoic acid
CasNumber
14657-64-8
MolecularFormula
C9H11O4P
MolecularWeight
214.155
MdlNumber
MFCD08704562
Smiles
OC(=O)CCP(=O)(c1ccccc1)O
Complexity
245
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
-0.1
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CatalogNumber: AA64812
ChemicalName: 3-Hydroxyphenylphosphinyl-propanoic acid
CasNumber: 14657-64-8
MolecularFormula: C9H11O4P
MolecularWeight: 214.155
MdlNumber: MFCD08704562
Smiles: OC(=O)CCP(=O)(c1ccccc1)O
Complexity: 245
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: -0.1
CatalogNumber:
AA64812
ChemicalName:
3-Hydroxyphenylphosphinyl-propanoic acid
CasNumber:
14657-64-8
MolecularFormula:
C9H11O4P
MolecularWeight:
214.155
MdlNumber:
MFCD08704562
Smiles:
OC(=O)CCP(=O)(c1ccccc1)O
Complexity:
245
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cc2c(n1S(=O)(=O)c1ccccc1)nccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cc2c(n1S(=O)(=O)c1ccccc1)nccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1=Nc2c3c(N1)cccc3ccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1=Nc2c3c(N1)cccc3ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA64819
ChemicalName: Ethyl 5-bromovalerate
CasNumber: 14660-52-7
MolecularFormula: C7H13BrO2
MolecularWeight: 209.0809
MdlNumber: MFCD00000266
Smiles: BrCCCCC(=O)OCC
Complexity: 93.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 6
Xlogp3: 1.9
CatalogNumber:
AA64819
ChemicalName:
Ethyl 5-bromovalerate
CasNumber:
14660-52-7
MolecularFormula:
C7H13BrO2
MolecularWeight:
209.0809
MdlNumber:
MFCD00000266
Smiles:
BrCCCCC(=O)OCC
Complexity:
93.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
6
Xlogp3:
1.9