AE43518
1350377-66-0 | 3-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzenamine
Manufacturer: A2B Chem
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CatalogNumber
AE43518
ChemicalName
3-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzenamine
CasNumber
1350377-66-0
MolecularFormula
C13H20BNO3
MolecularWeight
249.1138
MdlNumber
MFCD22494808
Smiles
COc1cc(N)ccc1B1OC(C(O1)(C)C)(C)C
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AE43518
ChemicalName: 3-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzenamine
CasNumber: 1350377-66-0
MolecularFormula: C13H20BNO3
MolecularWeight: 249.1138
MdlNumber: MFCD22494808
Smiles: COc1cc(N)ccc1B1OC(C(O1)(C)C)(C)C
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AE43518
ChemicalName:
3-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzenamine
CasNumber:
1350377-66-0
MolecularFormula:
C13H20BNO3
MolecularWeight:
249.1138
MdlNumber:
MFCD22494808
Smiles:
COc1cc(N)ccc1B1OC(C(O1)(C)C)(C)C
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
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Smiles: CC1=CC=C(C=C1)S(=O)(=O)O.CNC(=O)C1=NC=CC(=C1)OC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F
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Smiles:
CC1=CC=C(C=C1)S(=O)(=O)O.CNC(=O)C1=NC=CC(=C1)OC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F
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Smiles: CC1C(OCCN1)C2=CC(=CC=C2)F
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Smiles:
CC1C(OCCN1)C2=CC(=CC=C2)F
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Smiles: NC(=O)[C@H]([C@H](C(=O)N[C@H]1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2)CCC(F)(F)F)CCC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NC(=O)[C@H]([C@H](C(=O)N[C@H]1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2)CCC(F)(F)F)CCC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__