AA49024
1365272-23-6 | 3-[3-(Carboxymethyl)phenyl]benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA49024
ChemicalName
3-[3-(Carboxymethyl)phenyl]benzoic acid
CasNumber
1365272-23-6
MolecularFormula
C15H12O4
MolecularWeight
256.2534
MdlNumber
MFCD21609594
Smiles
OC(=O)Cc1cccc(c1)c1cccc(c1)C(=O)O
Complexity
339
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
2.8
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CatalogNumber: AA49024
ChemicalName: 3-[3-(Carboxymethyl)phenyl]benzoic acid
CasNumber: 1365272-23-6
MolecularFormula: C15H12O4
MolecularWeight: 256.2534
MdlNumber: MFCD21609594
Smiles: OC(=O)Cc1cccc(c1)c1cccc(c1)C(=O)O
Complexity: 339
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 2.8
CatalogNumber:
AA49024
ChemicalName:
3-[3-(Carboxymethyl)phenyl]benzoic acid
CasNumber:
1365272-23-6
MolecularFormula:
C15H12O4
MolecularWeight:
256.2534
MdlNumber:
MFCD21609594
Smiles:
OC(=O)Cc1cccc(c1)c1cccc(c1)C(=O)O
Complexity:
339
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
2.8
CatalogNumber: AA49025
ChemicalName: 5-Bromo-1-cyclopentyl-6-fluorobenzimidazole
CasNumber: 1365272-22-5
MolecularFormula: C12H12BrFN2
MolecularWeight: 283.1395
MdlNumber: MFCD21609574
Smiles: Brc1cc2ncn(c2cc1F)C1CCCC1
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 3.4
CatalogNumber:
AA49025
ChemicalName:
5-Bromo-1-cyclopentyl-6-fluorobenzimidazole
CasNumber:
1365272-22-5
MolecularFormula:
C12H12BrFN2
MolecularWeight:
283.1395
MdlNumber:
MFCD21609574
Smiles:
Brc1cc2ncn(c2cc1F)C1CCCC1
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
3.4
CatalogNumber: AA49026
ChemicalName: 1-Bromo-2-ethoxy-5-fluoro-3-nitrobenzene
CasNumber: 1365272-21-4
MolecularFormula: C8H7BrFNO3
MolecularWeight: 264.0485
MdlNumber: MFCD21609502
Smiles: CCOc1c(Br)cc(cc1[N+](=O)[O-])F
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AA49026
ChemicalName:
1-Bromo-2-ethoxy-5-fluoro-3-nitrobenzene
CasNumber:
1365272-21-4
MolecularFormula:
C8H7BrFNO3
MolecularWeight:
264.0485
MdlNumber:
MFCD21609502
Smiles:
CCOc1c(Br)cc(cc1[N+](=O)[O-])F
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1cccc(c1)c1cc(C)ccc1F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cccc(c1)c1cc(C)ccc1F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__