AF61335
212127-71-4 | 3-(Allyloxy)prop-1-en-2-ylboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AF61335
ChemicalName
3-(Allyloxy)prop-1-en-2-ylboronic acid pinacol ester
CasNumber
212127-71-4
MolecularFormula
C12H21BO3
MolecularWeight
224.1043
MdlNumber
MFCD13619879
Smiles
C=CCOCC(=C)B1OC(C(O1)(C)C)(C)C
Complexity
268
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
RotatableBondCount
5
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CatalogNumber: AF61335
ChemicalName: 3-(Allyloxy)prop-1-en-2-ylboronic acid pinacol ester
CasNumber: 212127-71-4
MolecularFormula: C12H21BO3
MolecularWeight: 224.1043
MdlNumber: MFCD13619879
Smiles: C=CCOCC(=C)B1OC(C(O1)(C)C)(C)C
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
CatalogNumber:
AF61335
ChemicalName:
3-(Allyloxy)prop-1-en-2-ylboronic acid pinacol ester
CasNumber:
212127-71-4
MolecularFormula:
C12H21BO3
MolecularWeight:
224.1043
MdlNumber:
MFCD13619879
Smiles:
C=CCOCC(=C)B1OC(C(O1)(C)C)(C)C
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: F[B-](C#CCCCC)(F)F.[K+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
F[B-](C#CCCCC)(F)F.[K+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AF61337
ChemicalName: 4-(3-Chlorobenzoyl)morpholine
CasNumber: 26162-86-7
MolecularFormula: C11H12ClNO2
MolecularWeight: 225.6715
MdlNumber: MFCD00455512
Smiles: Clc1cccc(c1)C(=O)N1CCOCC1
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
CatalogNumber:
AF61337
ChemicalName:
4-(3-Chlorobenzoyl)morpholine
CasNumber:
26162-86-7
MolecularFormula:
C11H12ClNO2
MolecularWeight:
225.6715
MdlNumber:
MFCD00455512
Smiles:
Clc1cccc(c1)C(=O)N1CCOCC1
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[n+]1ccc(cc1)/C/1=C/2C=CC(=N2)/C(=C/2[C]3(=C(c4cc[n+](cc4)C)C4=N/C(=C(c5n(c1cc5)[Zn]3)/c1cc[n+](cc1)C)/C=C4)C=C2)/c1cc[n+](cc1)C.[Cl-].[Cl-].[Cl-].[Cl-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[n+]1ccc(cc1)/C/1=C/2C=CC(=N2)/C(=C/2[C]3(=C(c4cc[n+](cc4)C)C4=N/C(=C(c5n(c1cc5)[Zn]3)/c1cc[n+](cc1)C)/C=C4)C=C2)/c1cc[n+](cc1)C.[Cl-].[Cl-].[Cl-].[Cl-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__