AD94842
850568-48-8 | 4-(3-Hydroxypropyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AD94842
ChemicalName
4-(3-Hydroxypropyl)phenylboronic acid
CasNumber
850568-48-8
MolecularFormula
C9H13BO3
MolecularWeight
180.00872000000007
MdlNumber
MFCD04973734
Smiles
OCCCc1ccc(cc1)B(O)O
Complexity
133
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
4
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CatalogNumber: AD94842
ChemicalName: 4-(3-Hydroxypropyl)phenylboronic acid
CasNumber: 850568-48-8
MolecularFormula: C9H13BO3
MolecularWeight: 180.00872000000007
MdlNumber: MFCD04973734
Smiles: OCCCc1ccc(cc1)B(O)O
Complexity: 133
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 4
CatalogNumber:
AD94842
ChemicalName:
4-(3-Hydroxypropyl)phenylboronic acid
CasNumber:
850568-48-8
MolecularFormula:
C9H13BO3
MolecularWeight:
180.00872000000007
MdlNumber:
MFCD04973734
Smiles:
OCCCc1ccc(cc1)B(O)O
Complexity:
133
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
4
CatalogNumber: AD94843
ChemicalName: 3-Amino-4-chlorophenylboronic acid, HCl
CasNumber: 850568-45-5
MolecularFormula: C6H8BCl2NO2
MolecularWeight: 207.8502
MdlNumber: MFCD04115643
Smiles: OB(c1ccc(c(c1)N)Cl)O.Cl
Complexity: 136
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 4
RotatableBondCount: 1
CatalogNumber:
AD94843
ChemicalName:
3-Amino-4-chlorophenylboronic acid, HCl
CasNumber:
850568-45-5
MolecularFormula:
C6H8BCl2NO2
MolecularWeight:
207.8502
MdlNumber:
MFCD04115643
Smiles:
OB(c1ccc(c(c1)N)Cl)O.Cl
Complexity:
136
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
4
RotatableBondCount:
1
CatalogNumber: AD94844
ChemicalName: 3-Ethoxycarbonyl-5-nitrophenylboronic acid
CasNumber: 850568-37-5
MolecularFormula: C9H10BNO6
MolecularWeight: 238.9898
MdlNumber: MFCD03788422
Smiles: CCOC(=O)c1cc(cc(c1)[N+](=O)[O-])B(O)O
Complexity: 292
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AD94844
ChemicalName:
3-Ethoxycarbonyl-5-nitrophenylboronic acid
CasNumber:
850568-37-5
MolecularFormula:
C9H10BNO6
MolecularWeight:
238.9898
MdlNumber:
MFCD03788422
Smiles:
CCOC(=O)c1cc(cc(c1)[N+](=O)[O-])B(O)O
Complexity:
292
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(Oc1ccc(c(c1)F)N)C.Cl
Complexity: 141
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(Oc1ccc(c(c1)F)N)C.Cl
Complexity:
141
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__