AB59031
111128-12-2 | 2-(4-(Bromomethyl)phenyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB59031
ChemicalName
2-(4-(Bromomethyl)phenyl)propanoic acid
CasNumber
111128-12-2
MolecularFormula
C10H11BrO2
MolecularWeight
243.0971
MdlNumber
MFCD02093445
Smiles
BrCc1ccc(cc1)C(C(=O)O)C
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
2.5
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CatalogNumber: AB59031
ChemicalName: 2-(4-(Bromomethyl)phenyl)propanoic acid
CasNumber: 111128-12-2
MolecularFormula: C10H11BrO2
MolecularWeight: 243.0971
MdlNumber: MFCD02093445
Smiles: BrCc1ccc(cc1)C(C(=O)O)C
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.5
CatalogNumber:
AB59031
ChemicalName:
2-(4-(Bromomethyl)phenyl)propanoic acid
CasNumber:
111128-12-2
MolecularFormula:
C10H11BrO2
MolecularWeight:
243.0971
MdlNumber:
MFCD02093445
Smiles:
BrCc1ccc(cc1)C(C(=O)O)C
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)C=C(c1ccccc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cc1)C=C(c1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB59033
ChemicalName: 2-(4-Bromophenyl)-1,3-dioxolane
CasNumber: 10602-01-4
MolecularFormula: C9H9BrO2
MolecularWeight: 229.0706
MdlNumber: MFCD01318950
Smiles: Brc1ccc(cc1)C1OCCO1
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 2
CatalogNumber:
AB59033
ChemicalName:
2-(4-Bromophenyl)-1,3-dioxolane
CasNumber:
10602-01-4
MolecularFormula:
C9H9BrO2
MolecularWeight:
229.0706
MdlNumber:
MFCD01318950
Smiles:
Brc1ccc(cc1)C1OCCO1
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
2
CatalogNumber: AB59034
ChemicalName: 2-(4-Bromophenyl)-2,3-dihydro-1h-naphtho[1,8-de][1,3,2]diazaborine
CasNumber: 927384-44-9
MolecularFormula: C16H12BBrN2
MolecularWeight: 322.9949
MdlNumber: MFCD16038141
Smiles: Brc1ccc(cc1)B1Nc2cccc3c2c(N1)ccc3
Complexity: 325
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB59034
ChemicalName:
2-(4-Bromophenyl)-2,3-dihydro-1h-naphtho[1,8-de][1,3,2]diazaborine
CasNumber:
927384-44-9
MolecularFormula:
C16H12BBrN2
MolecularWeight:
322.9949
MdlNumber:
MFCD16038141
Smiles:
Brc1ccc(cc1)B1Nc2cccc3c2c(N1)ccc3
Complexity:
325
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
__