AD35583
389621-80-1 | 4-(N,N-Diethylaminocarbonyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AD35583
ChemicalName
4-(N,N-Diethylaminocarbonyl)phenylboronic acid
CasNumber
389621-80-1
MolecularFormula
C11H16BNO3
MolecularWeight
221.0606
MdlNumber
MFCD03411949
Smiles
CCN(C(=O)c1ccc(cc1)B(O)O)CC
Complexity
223
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AD35583
ChemicalName: 4-(N,N-Diethylaminocarbonyl)phenylboronic acid
CasNumber: 389621-80-1
MolecularFormula: C11H16BNO3
MolecularWeight: 221.0606
MdlNumber: MFCD03411949
Smiles: CCN(C(=O)c1ccc(cc1)B(O)O)CC
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AD35583
ChemicalName:
4-(N,N-Diethylaminocarbonyl)phenylboronic acid
CasNumber:
389621-80-1
MolecularFormula:
C11H16BNO3
MolecularWeight:
221.0606
MdlNumber:
MFCD03411949
Smiles:
CCN(C(=O)c1ccc(cc1)B(O)O)CC
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AD35584
ChemicalName: 4-(2-Aminoethyl)tetrahydropyran, HCl
CasNumber: 389621-77-6
MolecularFormula: C7H16ClNO
MolecularWeight: 165.661
MdlNumber: MFCD03411927
Smiles: NCCC1CCOCC1.Cl
Complexity: 69.3
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AD35584
ChemicalName:
4-(2-Aminoethyl)tetrahydropyran, HCl
CasNumber:
389621-77-6
MolecularFormula:
C7H16ClNO
MolecularWeight:
165.661
MdlNumber:
MFCD03411927
Smiles:
NCCC1CCOCC1.Cl
Complexity:
69.3
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]C(=O)O.[O-]C(=O)O.[Ca+2]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]C(=O)O.[O-]C(=O)O.[Ca+2]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AD35588
ChemicalName: 2-Oxo-2,3-dihydro-1H-imidazole-4-carboxylic acid
CasNumber: 39828-47-2
MolecularFormula: C4H4N2O3
MolecularWeight: 128.0862
MdlNumber: MFCD01547735
Smiles: OC(=O)c1c[nH]c(=O)[nH]1
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
CatalogNumber:
AD35588
ChemicalName:
2-Oxo-2,3-dihydro-1H-imidazole-4-carboxylic acid
CasNumber:
39828-47-2
MolecularFormula:
C4H4N2O3
MolecularWeight:
128.0862
MdlNumber:
MFCD01547735
Smiles:
OC(=O)c1c[nH]c(=O)[nH]1
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1