AC06363
883899-02-3 | 2-Cyano-3-methoxyphenylboronic acid neopentyl glycol ester
Manufacturer: A2B Chem
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CatalogNumber
AC06363
ChemicalName
2-Cyano-3-methoxyphenylboronic acid neopentyl glycol ester
CasNumber
883899-02-3
MolecularFormula
C13H16BNO3
MolecularWeight
245.082
MdlNumber
MFCD08669558
Smiles
N#Cc1c(OC)cccc1B1OCC(CO1)(C)C
Complexity
328
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
2
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CatalogNumber: AC06363
ChemicalName: 2-Cyano-3-methoxyphenylboronic acid neopentyl glycol ester
CasNumber: 883899-02-3
MolecularFormula: C13H16BNO3
MolecularWeight: 245.082
MdlNumber: MFCD08669558
Smiles: N#Cc1c(OC)cccc1B1OCC(CO1)(C)C
Complexity: 328
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
CatalogNumber:
AC06363
ChemicalName:
2-Cyano-3-methoxyphenylboronic acid neopentyl glycol ester
CasNumber:
883899-02-3
MolecularFormula:
C13H16BNO3
MolecularWeight:
245.082
MdlNumber:
MFCD08669558
Smiles:
N#Cc1c(OC)cccc1B1OCC(CO1)(C)C
Complexity:
328
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
CatalogNumber: AC06364
ChemicalName: 2-Cyano-6-methoxyphenylboronic acid neopentyl glycol ester
CasNumber: 883898-97-3
MolecularFormula: C13H16BNO3
MolecularWeight: 245.082
MdlNumber: MFCD08669557
Smiles: COc1cccc(c1B1OCC(CO1)(C)C)C#N
Complexity: 328
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
CatalogNumber:
AC06364
ChemicalName:
2-Cyano-6-methoxyphenylboronic acid neopentyl glycol ester
CasNumber:
883898-97-3
MolecularFormula:
C13H16BNO3
MolecularWeight:
245.082
MdlNumber:
MFCD08669557
Smiles:
COc1cccc(c1B1OCC(CO1)(C)C)C#N
Complexity:
328
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
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Smiles: Clc1ccc2c(c1)n(cc2)S(=O)(=O)C
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Smiles:
Clc1ccc2c(c1)n(cc2)S(=O)(=O)C
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Smiles: FC(c1ccccc1B(O)O)F
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Smiles:
FC(c1ccccc1B(O)O)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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