AB42621
60456-21-5 | Methyl (S)-(-)-2,2-dimethyl-1,3-dioxolane-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB42621
ChemicalName
Methyl (S)-(-)-2,2-dimethyl-1,3-dioxolane-4-carboxylate
CasNumber
60456-21-5
MolecularFormula
C7H12O4
MolecularWeight
160.1678
MdlNumber
MFCD00066526
Smiles
COC(=O)[C@@H]1COC(O1)(C)C
Complexity
164
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
0.4
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CatalogNumber: AB42621
ChemicalName: Methyl (S)-(-)-2,2-dimethyl-1,3-dioxolane-4-carboxylate
CasNumber: 60456-21-5
MolecularFormula: C7H12O4
MolecularWeight: 160.1678
MdlNumber: MFCD00066526
Smiles: COC(=O)[C@@H]1COC(O1)(C)C
Complexity: 164
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.4
CatalogNumber:
AB42621
ChemicalName:
Methyl (S)-(-)-2,2-dimethyl-1,3-dioxolane-4-carboxylate
CasNumber:
60456-21-5
MolecularFormula:
C7H12O4
MolecularWeight:
160.1678
MdlNumber:
MFCD00066526
Smiles:
COC(=O)[C@@H]1COC(O1)(C)C
Complexity:
164
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CC=CCCC=C1.c1cccnc1.C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.F[P-](F)(F)(F)(F)F.[Ir+]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CC=CCCC=C1.c1cccnc1.C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.F[P-](F)(F)(F)(F)F.[Ir+]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCCc1ccccc1
Complexity: 65
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCCc1ccccc1
Complexity:
65
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3
CatalogNumber: AB42624
ChemicalName: 2-Chlorobenzophenone
CasNumber: 5162-03-8
MolecularFormula: C13H9ClO
MolecularWeight: 216.66296000000003
MdlNumber: MFCD00000558
Smiles: Clc1ccccc1C(=O)c1ccccc1
Complexity: 221
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 4
CatalogNumber:
AB42624
ChemicalName:
2-Chlorobenzophenone
CasNumber:
5162-03-8
MolecularFormula:
C13H9ClO
MolecularWeight:
216.66296000000003
MdlNumber:
MFCD00000558
Smiles:
Clc1ccccc1C(=O)c1ccccc1
Complexity:
221
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
4