AI39537
1793003-79-8 | 3-Butoxy-5-chloro-4-isopropoxyphenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AI39537
ChemicalName
3-Butoxy-5-chloro-4-isopropoxyphenylboronic acid
CasNumber
1793003-79-8
MolecularFormula
C13H20BClO4
MolecularWeight
286.5595
MdlNumber
MFCD21332928
Smiles
CCCCOc1cc(cc(c1OC(C)C)Cl)B(O)O
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
7
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CatalogNumber: AI39537
ChemicalName: 3-Butoxy-5-chloro-4-isopropoxyphenylboronic acid
CasNumber: 1793003-79-8
MolecularFormula: C13H20BClO4
MolecularWeight: 286.5595
MdlNumber: MFCD21332928
Smiles: CCCCOc1cc(cc(c1OC(C)C)Cl)B(O)O
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 7
CatalogNumber:
AI39537
ChemicalName:
3-Butoxy-5-chloro-4-isopropoxyphenylboronic acid
CasNumber:
1793003-79-8
MolecularFormula:
C13H20BClO4
MolecularWeight:
286.5595
MdlNumber:
MFCD21332928
Smiles:
CCCCOc1cc(cc(c1OC(C)C)Cl)B(O)O
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
7
CatalogNumber: AI39538
ChemicalName: 3-Ethoxy-2-fluoro-5-(trifluoromethoxy)phenylboronic acid
CasNumber: 1793003-82-3
MolecularFormula: C9H9BF4O4
MolecularWeight: 267.97
MdlNumber: MFCD21609533
Smiles: CCOc1cc(cc(c1F)B(O)O)OC(F)(F)F
Complexity: 263
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AI39538
ChemicalName:
3-Ethoxy-2-fluoro-5-(trifluoromethoxy)phenylboronic acid
CasNumber:
1793003-82-3
MolecularFormula:
C9H9BF4O4
MolecularWeight:
267.97
MdlNumber:
MFCD21609533
Smiles:
CCOc1cc(cc(c1F)B(O)O)OC(F)(F)F
Complexity:
263
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
4
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Smiles: BrCCCCn1nncc1
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Smiles:
BrCCCCn1nncc1
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Smiles: CCOC(=O)CCC1CCCC1
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Smiles:
CCOC(=O)CCC1CCCC1
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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