AG79807
62433-22-1 | 4-Fluorophenyl 2-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AG79807
ChemicalName
4-Fluorophenyl 2-nitrobenzoate
CasNumber
62433-22-1
MolecularFormula
C13H8FNO4
MolecularWeight
261.2053
MdlNumber
MFCD25953893
Smiles
Fc1ccc(cc1)OC(=O)c1ccccc1[N+](=O)[O-]
Complexity
336
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
3.3
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CatalogNumber: AG79807
ChemicalName: 4-Fluorophenyl 2-nitrobenzoate
CasNumber: 62433-22-1
MolecularFormula: C13H8FNO4
MolecularWeight: 261.2053
MdlNumber: MFCD25953893
Smiles: Fc1ccc(cc1)OC(=O)c1ccccc1[N+](=O)[O-]
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AG79807
ChemicalName:
4-Fluorophenyl 2-nitrobenzoate
CasNumber:
62433-22-1
MolecularFormula:
C13H8FNO4
MolecularWeight:
261.2053
MdlNumber:
MFCD25953893
Smiles:
Fc1ccc(cc1)OC(=O)c1ccccc1[N+](=O)[O-]
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: AG79808
ChemicalName: Ethyl 3-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
CasNumber: 6124-13-6
MolecularFormula: C10H10N2O3S
MolecularWeight: 238.263
MdlNumber: MFCD24847006
Smiles: CCOC(=O)c1cnc2n(c1=O)c(C)cs2
Complexity: 451
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AG79808
ChemicalName:
Ethyl 3-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
CasNumber:
6124-13-6
MolecularFormula:
C10H10N2O3S
MolecularWeight:
238.263
MdlNumber:
MFCD24847006
Smiles:
CCOC(=O)c1cnc2n(c1=O)c(C)cs2
Complexity:
451
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: AG79809
ChemicalName: 4-(Cyclopropylsulfonyl)phenylboronic acid pinacol ester
CasNumber: 648906-27-8
MolecularFormula: C15H21BO4S
MolecularWeight: 308.2008399999999
MdlNumber: MFCD24448818
Smiles: CC1(C)OB(OC1(C)C)c1ccc(cc1)S(=O)(=O)C1CC1
Complexity: 480
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AG79809
ChemicalName:
4-(Cyclopropylsulfonyl)phenylboronic acid pinacol ester
CasNumber:
648906-27-8
MolecularFormula:
C15H21BO4S
MolecularWeight:
308.2008399999999
MdlNumber:
MFCD24448818
Smiles:
CC1(C)OB(OC1(C)C)c1ccc(cc1)S(=O)(=O)C1CC1
Complexity:
480
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AG79811
ChemicalName: 2-Fluoro-4-methoxyphenylboronic acid pinacol ester
CasNumber: 628692-21-7
MolecularFormula: C13H18BFO3
MolecularWeight: 252.0896232
MdlNumber: MFCD16996299
Smiles: COc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AG79811
ChemicalName:
2-Fluoro-4-methoxyphenylboronic acid pinacol ester
CasNumber:
628692-21-7
MolecularFormula:
C13H18BFO3
MolecularWeight:
252.0896232
MdlNumber:
MFCD16996299
Smiles:
COc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
__