AH83821
913835-94-6 | Ethyl 4-borono-3-chlorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AH83821
ChemicalName
Ethyl 4-borono-3-chlorobenzoate
CasNumber
913835-94-6
MolecularFormula
C9H10BClO4
MolecularWeight
228.4373
MdlNumber
MFCD08689531
Smiles
CCOC(=O)c1ccc(c(c1)Cl)B(O)O
Complexity
224
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AH83821
ChemicalName: Ethyl 4-borono-3-chlorobenzoate
CasNumber: 913835-94-6
MolecularFormula: C9H10BClO4
MolecularWeight: 228.4373
MdlNumber: MFCD08689531
Smiles: CCOC(=O)c1ccc(c(c1)Cl)B(O)O
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AH83821
ChemicalName:
Ethyl 4-borono-3-chlorobenzoate
CasNumber:
913835-94-6
MolecularFormula:
C9H10BClO4
MolecularWeight:
228.4373
MdlNumber:
MFCD08689531
Smiles:
CCOC(=O)c1ccc(c(c1)Cl)B(O)O
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AH83822
ChemicalName: 4-(1H-Pyrrol-1-ylsulfonyl)phenylboronic acid
CasNumber: 913835-90-2
MolecularFormula: C10H10BNO4S
MolecularWeight: 251.0667
MdlNumber: MFCD08689522
Smiles: OB(c1ccc(cc1)S(=O)(=O)n1cccc1)O
Complexity: 340
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AH83822
ChemicalName:
4-(1H-Pyrrol-1-ylsulfonyl)phenylboronic acid
CasNumber:
913835-90-2
MolecularFormula:
C10H10BNO4S
MolecularWeight:
251.0667
MdlNumber:
MFCD08689522
Smiles:
OB(c1ccc(cc1)S(=O)(=O)n1cccc1)O
Complexity:
340
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
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Smiles: F[P-](F)(F)(F)(F)F.Oc1ccc2c(c1)c1c3C(=O)N(C(=O)c3c3c4c1[n+]2[Pt-2]([n+]1cc(O)ccc1C)([n+]1cc(F)ccc1Br)n4ccc3)C
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Smiles:
F[P-](F)(F)(F)(F)F.Oc1ccc2c(c1)c1c3C(=O)N(C(=O)c3c3c4c1[n+]2[Pt-2]([n+]1cc(O)ccc1C)([n+]1cc(F)ccc1Br)n4ccc3)C
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Smiles: COc1ccc(cc1OC(=O)C)B1OC(C(O1)(C)C)(C)C
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MolecularFormula:
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Smiles:
COc1ccc(cc1OC(=O)C)B1OC(C(O1)(C)C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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