AB04508
20330-90-9 | Dimethyl 5-chloroisophthalate
Manufacturer: A2B Chem
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CatalogNumber
AB04508
ChemicalName
Dimethyl 5-chloroisophthalate
CasNumber
20330-90-9
MolecularFormula
C10H9ClO4
MolecularWeight
228.6291
MdlNumber
MFCD00079752
Smiles
COC(=O)c1cc(Cl)cc(c1)C(=O)OC
NscNumber
13963
Complexity
230
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
2.3
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CatalogNumber: AB04508
ChemicalName: Dimethyl 5-chloroisophthalate
CasNumber: 20330-90-9
MolecularFormula: C10H9ClO4
MolecularWeight: 228.6291
MdlNumber: MFCD00079752
Smiles: COC(=O)c1cc(Cl)cc(c1)C(=O)OC
NscNumber: 13963
Complexity: 230
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.3
CatalogNumber:
AB04508
ChemicalName:
Dimethyl 5-chloroisophthalate
CasNumber:
20330-90-9
MolecularFormula:
C10H9ClO4
MolecularWeight:
228.6291
MdlNumber:
MFCD00079752
Smiles:
COC(=O)c1cc(Cl)cc(c1)C(=O)OC
NscNumber:
13963
Complexity:
230
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1ccc(cc1)C(C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC(=O)Nc1ccc(cc1)C(C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB04512
ChemicalName: 3,4-Dimethoxyphenol
CasNumber: 2033-89-8
MolecularFormula: C8H10O3
MolecularWeight: 154.1632
MdlNumber: MFCD00008390
Smiles: COc1cc(O)ccc1OC
NscNumber: 140927
Complexity: 116
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AB04512
ChemicalName:
3,4-Dimethoxyphenol
CasNumber:
2033-89-8
MolecularFormula:
C8H10O3
MolecularWeight:
154.1632
MdlNumber:
MFCD00008390
Smiles:
COc1cc(O)ccc1OC
NscNumber:
140927
Complexity:
116
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCCCOc1ccc(cc1)OC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCCCOc1ccc(cc1)OC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__