AD36873
3964-58-7 | 3-Chloro-4-hydroxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AD36873
ChemicalName
3-Chloro-4-hydroxybenzoic acid
CasNumber
3964-58-7
MolecularFormula
C7H5ClO3
MolecularWeight
172.5658
MdlNumber
MFCD00002549
Smiles
OC(=O)c1ccc(c(c1)Cl)O
NscNumber
21186
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AD36873
ChemicalName: 3-Chloro-4-hydroxybenzoic acid
CasNumber: 3964-58-7
MolecularFormula: C7H5ClO3
MolecularWeight: 172.5658
MdlNumber: MFCD00002549
Smiles: OC(=O)c1ccc(c(c1)Cl)O
NscNumber: 21186
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AD36873
ChemicalName:
3-Chloro-4-hydroxybenzoic acid
CasNumber:
3964-58-7
MolecularFormula:
C7H5ClO3
MolecularWeight:
172.5658
MdlNumber:
MFCD00002549
Smiles:
OC(=O)c1ccc(c(c1)Cl)O
NscNumber:
21186
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(C(=O)O)Oc1cc(Cl)cc(c1)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(C(=O)O)Oc1cc(Cl)cc(c1)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@H]1CNCC[C@@H]1O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@H]1CNCC[C@@H]1O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD36877
ChemicalName: Methacycline hydrochloride
CasNumber: 3963-95-9
MolecularFormula: C22H23ClN2O8
MolecularWeight: 478.8796
MdlNumber: MFCD04972012
Smiles: CN([C@@H]1C(=O)/C(=C(/O)N)/C(=O)[C@@]2([C@H]1[C@@H](O)[C@@H]1C(=C)c3cccc(c3C(=C1C2=O)O)O)O)C.Cl
NscNumber: __
Complexity: 998
Covalently-bondedUnitCount: 2
HeavyAtomCount: 33
HydrogenBondAcceptorCount: 9
HydrogenBondDonorCount: 7
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AD36877
ChemicalName:
Methacycline hydrochloride
CasNumber:
3963-95-9
MolecularFormula:
C22H23ClN2O8
MolecularWeight:
478.8796
MdlNumber:
MFCD04972012
Smiles:
CN([C@@H]1C(=O)/C(=C(/O)N)/C(=O)[C@@]2([C@H]1[C@@H](O)[C@@H]1C(=C)c3cccc(c3C(=C1C2=O)O)O)O)C.Cl
NscNumber:
__
Complexity:
998
Covalently-bondedUnitCount:
2
HeavyAtomCount:
33
HydrogenBondAcceptorCount:
9
HydrogenBondDonorCount:
7
RotatableBondCount:
2
Xlogp3:
__