AB75786
6149-41-3 | Methyl 3-hydroxypropanoate
Manufacturer: A2B Chem
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CatalogNumber
AB75786
ChemicalName
Methyl 3-hydroxypropanoate
CasNumber
6149-41-3
MolecularFormula
C4H8O3
MolecularWeight
104.1045
MdlNumber
MFCD00272293
Smiles
COC(=O)CCO
Complexity
60
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
-0.6
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CatalogNumber: AB75786
ChemicalName: Methyl 3-hydroxypropanoate
CasNumber: 6149-41-3
MolecularFormula: C4H8O3
MolecularWeight: 104.1045
MdlNumber: MFCD00272293
Smiles: COC(=O)CCO
Complexity: 60
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: -0.6
CatalogNumber:
AB75786
ChemicalName:
Methyl 3-hydroxypropanoate
CasNumber:
6149-41-3
MolecularFormula:
C4H8O3
MolecularWeight:
104.1045
MdlNumber:
MFCD00272293
Smiles:
COC(=O)CCO
Complexity:
60
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
-0.6
CatalogNumber: AB75787
ChemicalName: Methyl 3-hydroxythiophene-2-carboxylate
CasNumber: 5118-06-9
MolecularFormula: C6H6O3S
MolecularWeight: 158.17504000000002
MdlNumber: MFCD00055642
Smiles: COC(=O)c1sccc1O
Complexity: 137
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AB75787
ChemicalName:
Methyl 3-hydroxythiophene-2-carboxylate
CasNumber:
5118-06-9
MolecularFormula:
C6H6O3S
MolecularWeight:
158.17504000000002
MdlNumber:
MFCD00055642
Smiles:
COC(=O)c1sccc1O
Complexity:
137
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(c(c1)I)NC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(c(c1)I)NC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(c(c1)I)C
Complexity: 170
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(c(c1)I)C
Complexity:
170
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8