AA56359
1226808-68-9 | 3-Bromo-5-propoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA56359
ChemicalName
3-Bromo-5-propoxybenzoic acid
CasNumber
1226808-68-9
MolecularFormula
C10H11BrO3
MolecularWeight
259.0965
MdlNumber
MFCD16295104
Smiles
CCCOc1cc(Br)cc(c1)C(=O)O
Complexity
196
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3
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CatalogNumber: AA56359
ChemicalName: 3-Bromo-5-propoxybenzoic acid
CasNumber: 1226808-68-9
MolecularFormula: C10H11BrO3
MolecularWeight: 259.0965
MdlNumber: MFCD16295104
Smiles: CCCOc1cc(Br)cc(c1)C(=O)O
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3
CatalogNumber:
AA56359
ChemicalName:
3-Bromo-5-propoxybenzoic acid
CasNumber:
1226808-68-9
MolecularFormula:
C10H11BrO3
MolecularWeight:
259.0965
MdlNumber:
MFCD16295104
Smiles:
CCCOc1cc(Br)cc(c1)C(=O)O
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3
CatalogNumber: AA56360
ChemicalName: 6-Bromo-2-chloro-3-methylphenol
CasNumber: 1226808-67-8
MolecularFormula: C7H6BrClO
MolecularWeight: 221.4789
MdlNumber: MFCD16295099
Smiles: Brc1ccc(c(c1O)Cl)C
Complexity: 120
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 3.3
CatalogNumber:
AA56360
ChemicalName:
6-Bromo-2-chloro-3-methylphenol
CasNumber:
1226808-67-8
MolecularFormula:
C7H6BrClO
MolecularWeight:
221.4789
MdlNumber:
MFCD16295099
Smiles:
Brc1ccc(c(c1O)Cl)C
Complexity:
120
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1snc(n1)C1CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1snc(n1)C1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=S)C1CCN(C1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=S)C1CCN(C1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__