AF36524
27563-65-1 | 3-Chlorophthalic acid
Manufacturer: A2B Chem
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CatalogNumber
AF36524
ChemicalName
3-Chlorophthalic acid
CasNumber
27563-65-1
MolecularFormula
C8H5ClO4
MolecularWeight
200.5759
MdlNumber
MFCD00100580
Smiles
C1=CC(=C(C(=C1)Cl)C(=O)O)C(=O)O
NscNumber
62536
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AF36524
ChemicalName: 3-Chlorophthalic acid
CasNumber: 27563-65-1
MolecularFormula: C8H5ClO4
MolecularWeight: 200.5759
MdlNumber: MFCD00100580
Smiles: C1=CC(=C(C(=C1)Cl)C(=O)O)C(=O)O
NscNumber: 62536
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AF36524
ChemicalName:
3-Chlorophthalic acid
CasNumber:
27563-65-1
MolecularFormula:
C8H5ClO4
MolecularWeight:
200.5759
MdlNumber:
MFCD00100580
Smiles:
C1=CC(=C(C(=C1)Cl)C(=O)O)C(=O)O
NscNumber:
62536
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCC(=O)c1ccc(c(c1)C)Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCC(=O)c1ccc(c(c1)C)Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCc1cnccc1CCl.Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCc1cnccc1CCl.Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF36527
ChemicalName: 3-Phenylnaphthalen-1-ol
CasNumber: 30069-65-9
MolecularFormula: C16H12O
MolecularWeight: 220.2659
MdlNumber: MFCD00474644
Smiles: Oc1cc(cc2c1cccc2)c1ccccc1
NscNumber: __
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 4.4
CatalogNumber:
AF36527
ChemicalName:
3-Phenylnaphthalen-1-ol
CasNumber:
30069-65-9
MolecularFormula:
C16H12O
MolecularWeight:
220.2659
MdlNumber:
MFCD00474644
Smiles:
Oc1cc(cc2c1cccc2)c1ccccc1
NscNumber:
__
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
4.4