AA92955
174671-50-2 | 2-Hydroxymethyl-5-(trifluoromethyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA92955
ChemicalName
2-Hydroxymethyl-5-(trifluoromethyl)phenylboronic acid
CasNumber
174671-50-2
MolecularFormula
C8H6BF3O2
MolecularWeight
201.9382
MdlNumber
MFCD10699482
Smiles
OB1OCc2c1ccc(c2)C(F)(F)F
Complexity
210
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AA92955
ChemicalName: 2-Hydroxymethyl-5-(trifluoromethyl)phenylboronic acid
CasNumber: 174671-50-2
MolecularFormula: C8H6BF3O2
MolecularWeight: 201.9382
MdlNumber: MFCD10699482
Smiles: OB1OCc2c1ccc(c2)C(F)(F)F
Complexity: 210
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AA92955
ChemicalName:
2-Hydroxymethyl-5-(trifluoromethyl)phenylboronic acid
CasNumber:
174671-50-2
MolecularFormula:
C8H6BF3O2
MolecularWeight:
201.9382
MdlNumber:
MFCD10699482
Smiles:
OB1OCc2c1ccc(c2)C(F)(F)F
Complexity:
210
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: AA92956
ChemicalName: 5-Fluorobenzo[c][1,2]oxaborol-1(3h)-ol
CasNumber: 174671-46-6
MolecularFormula: C7H6BFO2
MolecularWeight: 151.9307
MdlNumber: MFCD10699483
Smiles: Fc1ccc2c(c1)COB2O
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: __
CatalogNumber:
AA92956
ChemicalName:
5-Fluorobenzo[c][1,2]oxaborol-1(3h)-ol
CasNumber:
174671-46-6
MolecularFormula:
C7H6BFO2
MolecularWeight:
151.9307
MdlNumber:
MFCD10699483
Smiles:
Fc1ccc2c(c1)COB2O
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@@H]1CNCCN1Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@@H]1CNCCN1Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA92958
ChemicalName: N,N-Dimethyl-l-phenylalanine
CasNumber: 17469-89-5
MolecularFormula: C11H15NO2
MolecularWeight: 193.2423
MdlNumber: MFCD00082539
Smiles: CN([C@H](C(=O)O)Cc1ccccc1)C
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
CatalogNumber:
AA92958
ChemicalName:
N,N-Dimethyl-l-phenylalanine
CasNumber:
17469-89-5
MolecularFormula:
C11H15NO2
MolecularWeight:
193.2423
MdlNumber:
MFCD00082539
Smiles:
CN([C@H](C(=O)O)Cc1ccccc1)C
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4