AB50910
618-58-6 | 3,5-Dibromobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB50910
ChemicalName
3,5-Dibromobenzoic acid
CasNumber
618-58-6
MolecularFormula
C7H4Br2O2
MolecularWeight
279.9135
MdlNumber
MFCD00051758
Smiles
OC(=O)c1cc(Br)cc(c1)Br
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AB50910
ChemicalName: 3,5-Dibromobenzoic acid
CasNumber: 618-58-6
MolecularFormula: C7H4Br2O2
MolecularWeight: 279.9135
MdlNumber: MFCD00051758
Smiles: OC(=O)c1cc(Br)cc(c1)Br
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AB50910
ChemicalName:
3,5-Dibromobenzoic acid
CasNumber:
618-58-6
MolecularFormula:
C7H4Br2O2
MolecularWeight:
279.9135
MdlNumber:
MFCD00051758
Smiles:
OC(=O)c1cc(Br)cc(c1)Br
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(OB1OC(C(O1)(C)C)(C)C)C
Complexity: 173
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(OB1OC(C(O1)(C)C)(C)C)C
Complexity:
173
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1cscc1)O
Complexity: 78.4
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1cscc1)O
Complexity:
78.4
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50913
ChemicalName: 4-bromo-2,3-dihydro-1H-indene
CasNumber: 6134-53-8
MolecularFormula: C9H9Br
MolecularWeight: 197.0718
MdlNumber: MFCD22059711
Smiles: Brc1cccc2c1CCC2
Complexity: 122
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
AB50913
ChemicalName:
4-bromo-2,3-dihydro-1H-indene
CasNumber:
6134-53-8
MolecularFormula:
C9H9Br
MolecularWeight:
197.0718
MdlNumber:
MFCD22059711
Smiles:
Brc1cccc2c1CCC2
Complexity:
122
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4