AI04081
957034-31-0 | 3-(2,2-Dicyanovinyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AI04081
ChemicalName
3-(2,2-Dicyanovinyl)phenylboronic acid
CasNumber
957034-31-0
MolecularFormula
C10H7BN2O2
MolecularWeight
197.98578
MdlNumber
MFCD06214067
Smiles
N#CC(=Cc1cccc(c1)B(O)O)C#N
Complexity
329
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AI04081
ChemicalName: 3-(2,2-Dicyanovinyl)phenylboronic acid
CasNumber: 957034-31-0
MolecularFormula: C10H7BN2O2
MolecularWeight: 197.98578
MdlNumber: MFCD06214067
Smiles: N#CC(=Cc1cccc(c1)B(O)O)C#N
Complexity: 329
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AI04081
ChemicalName:
3-(2,2-Dicyanovinyl)phenylboronic acid
CasNumber:
957034-31-0
MolecularFormula:
C10H7BN2O2
MolecularWeight:
197.98578
MdlNumber:
MFCD06214067
Smiles:
N#CC(=Cc1cccc(c1)B(O)O)C#N
Complexity:
329
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1C=CC(=O)N1c1cccc(c1)C(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1C=CC(=O)N1c1cccc(c1)C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AI04087
ChemicalName: 4-Methylamino-3-nitrophenylboronic acid, pinacol ester
CasNumber: 956821-93-5
MolecularFormula: C13H19BN2O4
MolecularWeight: 278.112
MdlNumber: MFCD12026089
Smiles: CNc1ccc(cc1[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity: 367
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AI04087
ChemicalName:
4-Methylamino-3-nitrophenylboronic acid, pinacol ester
CasNumber:
956821-93-5
MolecularFormula:
C13H19BN2O4
MolecularWeight:
278.112
MdlNumber:
MFCD12026089
Smiles:
CNc1ccc(cc1[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity:
367
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1nn(c(c1)C)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1nn(c(c1)C)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__