AB99744
88275-88-1 | 3-Bromo-2-methoxyphenol
Manufacturer: A2B Chem
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CatalogNumber
AB99744
ChemicalName
3-Bromo-2-methoxyphenol
CasNumber
88275-88-1
MolecularFormula
C7H7BrO2
MolecularWeight
203.0333
MdlNumber
MFCD11053054
Smiles
COc1c(O)cccc1Br
Complexity
108
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AB99744
ChemicalName: 3-Bromo-2-methoxyphenol
CasNumber: 88275-88-1
MolecularFormula: C7H7BrO2
MolecularWeight: 203.0333
MdlNumber: MFCD11053054
Smiles: COc1c(O)cccc1Br
Complexity: 108
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AB99744
ChemicalName:
3-Bromo-2-methoxyphenol
CasNumber:
88275-88-1
MolecularFormula:
C7H7BrO2
MolecularWeight:
203.0333
MdlNumber:
MFCD11053054
Smiles:
COc1c(O)cccc1Br
Complexity:
108
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.2
CatalogNumber: AB99752
ChemicalName: 1-[(4-Bromo-2-fluorophenyl)carbonyl]pyrrolidine
CasNumber: 882689-88-5
MolecularFormula: C11H11BrFNO
MolecularWeight: 272.1135
MdlNumber: MFCD09950408
Smiles: Brc1ccc(c(c1)F)C(=O)N1CCCC1
Complexity: 243
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AB99752
ChemicalName:
1-[(4-Bromo-2-fluorophenyl)carbonyl]pyrrolidine
CasNumber:
882689-88-5
MolecularFormula:
C11H11BrFNO
MolecularWeight:
272.1135
MdlNumber:
MFCD09950408
Smiles:
Brc1ccc(c(c1)F)C(=O)N1CCCC1
Complexity:
243
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: AB99759
ChemicalName: 5-Methoxycarbonyl-2-methylphenylboronic acid pinacol ester
CasNumber: 882679-40-5
MolecularFormula: C15H21BO4
MolecularWeight: 276.1358
MdlNumber: MFCD11520530
Smiles: COC(=O)c1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB99759
ChemicalName:
5-Methoxycarbonyl-2-methylphenylboronic acid pinacol ester
CasNumber:
882679-40-5
MolecularFormula:
C15H21BO4
MolecularWeight:
276.1358
MdlNumber:
MFCD11520530
Smiles:
COC(=O)c1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC#CCC(C(/C=C/C1C(O)CC2C1c1cccc(c1O2)CCCC(=O)[O-])O)C.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC#CCC(C(/C=C/C1C(O)CC2C1c1cccc(c1O2)CCCC(=O)[O-])O)C.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__