AF00082
19677-37-3 | Diethyl 2-(4-chlorophenyl)malonate
Manufacturer: A2B Chem
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CatalogNumber
AF00082
ChemicalName
Diethyl 2-(4-chlorophenyl)malonate
CasNumber
19677-37-3
MolecularFormula
C13H15ClO4
MolecularWeight
270.7088
MdlNumber
MFCD06204602
Smiles
CCOC(=O)C(c1ccc(cc1)Cl)C(=O)OCC
NscNumber
106645
Complexity
267
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
7
Xlogp3
3.2
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CatalogNumber: AF00082
ChemicalName: Diethyl 2-(4-chlorophenyl)malonate
CasNumber: 19677-37-3
MolecularFormula: C13H15ClO4
MolecularWeight: 270.7088
MdlNumber: MFCD06204602
Smiles: CCOC(=O)C(c1ccc(cc1)Cl)C(=O)OCC
NscNumber: 106645
Complexity: 267
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 7
Xlogp3: 3.2
CatalogNumber:
AF00082
ChemicalName:
Diethyl 2-(4-chlorophenyl)malonate
CasNumber:
19677-37-3
MolecularFormula:
C13H15ClO4
MolecularWeight:
270.7088
MdlNumber:
MFCD06204602
Smiles:
CCOC(=O)C(c1ccc(cc1)Cl)C(=O)OCC
NscNumber:
106645
Complexity:
267
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
7
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)C(C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)C(C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].[Mn+2]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].[Mn+2]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF00086
ChemicalName: Dimethyl chloroterephthalate
CasNumber: 18643-84-0
MolecularFormula: C10H9ClO4
MolecularWeight: 228.6291
MdlNumber: MFCD00060639
Smiles: COC(=O)c1ccc(c(c1)Cl)C(=O)OC
NscNumber: __
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 3.3
CatalogNumber:
AF00086
ChemicalName:
Dimethyl chloroterephthalate
CasNumber:
18643-84-0
MolecularFormula:
C10H9ClO4
MolecularWeight:
228.6291
MdlNumber:
MFCD00060639
Smiles:
COC(=O)c1ccc(c(c1)Cl)C(=O)OC
NscNumber:
__
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
3.3