AB19413
209542-49-4 | m-PEG3-acid
Manufacturer: A2B Chem
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CatalogNumber
AB19413
ChemicalName
m-PEG3-acid
CasNumber
209542-49-4
MolecularFormula
C8H16O5
MolecularWeight
192.2096
MdlNumber
MFCD20646047
Smiles
COCCOCCOCCC(=O)O
Complexity
126
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
9
Xlogp3
-0.7
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CatalogNumber: AB19413
ChemicalName: m-PEG3-acid
CasNumber: 209542-49-4
MolecularFormula: C8H16O5
MolecularWeight: 192.2096
MdlNumber: MFCD20646047
Smiles: COCCOCCOCCC(=O)O
Complexity: 126
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 9
Xlogp3: -0.7
CatalogNumber:
AB19413
ChemicalName:
m-PEG3-acid
CasNumber:
209542-49-4
MolecularFormula:
C8H16O5
MolecularWeight:
192.2096
MdlNumber:
MFCD20646047
Smiles:
COCCOCCOCCC(=O)O
Complexity:
126
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
9
Xlogp3:
-0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3ccc(c2)NC(=O)c2c(F)c(F)c(c(c2F)F)F)ccc(c1)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3ccc(c2)NC(=O)c2c(F)c(F)c(c(c2F)F)F)ccc(c1)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: OC(=O)c1sc(nc1C)c1cccs1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1sc(nc1C)c1cccs1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: CN1C(=O)c2ccc3c4c2c(C1=O)ccc4C(=O)N(C3=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN1C(=O)c2ccc3c4c2c(C1=O)ccc4C(=O)N(C3=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__