AG29501
54221-37-3 | Diethyl meso-2,5-dibromoadipate
Manufacturer: A2B Chem
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CatalogNumber
AG29501
ChemicalName
Diethyl meso-2,5-dibromoadipate
CasNumber
54221-37-3
MolecularFormula
C10H16Br2O4
MolecularWeight
360.0396
MdlNumber
MFCD00075379
Smiles
CCOC(=O)[C@H](CC[C@H](C(=O)OCC)Br)Br
Complexity
209
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
9
Xlogp3
3.1
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CatalogNumber: AG29501
ChemicalName: Diethyl meso-2,5-dibromoadipate
CasNumber: 54221-37-3
MolecularFormula: C10H16Br2O4
MolecularWeight: 360.0396
MdlNumber: MFCD00075379
Smiles: CCOC(=O)[C@H](CC[C@H](C(=O)OCC)Br)Br
Complexity: 209
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 9
Xlogp3: 3.1
CatalogNumber:
AG29501
ChemicalName:
Diethyl meso-2,5-dibromoadipate
CasNumber:
54221-37-3
MolecularFormula:
C10H16Br2O4
MolecularWeight:
360.0396
MdlNumber:
MFCD00075379
Smiles:
CCOC(=O)[C@H](CC[C@H](C(=O)OCC)Br)Br
Complexity:
209
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
9
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@@H]1[C@H](O)CCN1C(=O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@@H]1[C@H](O)CCN1C(=O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG29503
ChemicalName: 4-(1-Hydroxyethyl)phenylboronic acid
CasNumber: 518336-20-4
MolecularFormula: C8H11BO3
MolecularWeight: 165.9821
MdlNumber: MFCD04112543
Smiles: OB(c1ccc(cc1)C(O)C)O
Complexity: 132
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AG29503
ChemicalName:
4-(1-Hydroxyethyl)phenylboronic acid
CasNumber:
518336-20-4
MolecularFormula:
C8H11BO3
MolecularWeight:
165.9821
MdlNumber:
MFCD04112543
Smiles:
OB(c1ccc(cc1)C(O)C)O
Complexity:
132
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1nc(ccc1B(O)O)C(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1nc(ccc1B(O)O)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__