AB67020
943552-04-3 | 2-(4-Bromophenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
Manufacturer: A2B Chem
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CatalogNumber
AB67020
ChemicalName
2-(4-Bromophenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
CasNumber
943552-04-3
MolecularFormula
C11H11BBrNO4
MolecularWeight
311.9243
MdlNumber
MFCD11215230
Smiles
O=C1[O-][B+3]2([N](C1)(C)CC(=O)[O-]2)[C-]1=CC=C(C=C1)Br
Complexity
313
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
RotatableBondCount
1
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CatalogNumber: AB67020
ChemicalName: 2-(4-Bromophenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
CasNumber: 943552-04-3
MolecularFormula: C11H11BBrNO4
MolecularWeight: 311.9243
MdlNumber: MFCD11215230
Smiles: O=C1[O-][B+3]2([N](C1)(C)CC(=O)[O-]2)[C-]1=CC=C(C=C1)Br
Complexity: 313
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
CatalogNumber:
AB67020
ChemicalName:
2-(4-Bromophenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
CasNumber:
943552-04-3
MolecularFormula:
C11H11BBrNO4
MolecularWeight:
311.9243
MdlNumber:
MFCD11215230
Smiles:
O=C1[O-][B+3]2([N](C1)(C)CC(=O)[O-]2)[C-]1=CC=C(C=C1)Br
Complexity:
313
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
CatalogNumber: AB67021
ChemicalName: 4-Bromophenylsulfur pentafluoride
CasNumber: 774-93-6
MolecularFormula: C6H4BrF5S
MolecularWeight: 283.057
MdlNumber: MFCD03425928
Smiles: Brc1ccc(cc1)S(F)(F)(F)(F)F
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: __
CatalogNumber:
AB67021
ChemicalName:
4-Bromophenylsulfur pentafluoride
CasNumber:
774-93-6
MolecularFormula:
C6H4BrF5S
MolecularWeight:
283.057
MdlNumber:
MFCD03425928
Smiles:
Brc1ccc(cc1)S(F)(F)(F)(F)F
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: CC(=O)Sc1ccc(cc1)Br
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Smiles:
CC(=O)Sc1ccc(cc1)Br
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: NC(=O)Nc1ccc(cc1)Br
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NC(=O)Nc1ccc(cc1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__