AI28894
1279115-53-5 | 2-(4-Iodophenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane
Manufacturer: A2B Chem
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CatalogNumber
AI28894
ChemicalName
2-(4-Iodophenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane
CasNumber
1279115-53-5
MolecularFormula
C12H16BIO2
MolecularWeight
329.9697
MdlNumber
MFCD28101505
Smiles
CC1OB(OC(C1)(C)C)c1ccc(cc1)I
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
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CatalogNumber: AI28894
ChemicalName: 2-(4-Iodophenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane
CasNumber: 1279115-53-5
MolecularFormula: C12H16BIO2
MolecularWeight: 329.9697
MdlNumber: MFCD28101505
Smiles: CC1OB(OC(C1)(C)C)c1ccc(cc1)I
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AI28894
ChemicalName:
2-(4-Iodophenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane
CasNumber:
1279115-53-5
MolecularFormula:
C12H16BIO2
MolecularWeight:
329.9697
MdlNumber:
MFCD28101505
Smiles:
CC1OB(OC(C1)(C)C)c1ccc(cc1)I
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CC(C1)c1nc2c(s1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
C1CC(C1)c1nc2c(s1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: CCOC(=O)c1ncoc1c1ccc(cc1)F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)c1ncoc1c1ccc(cc1)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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UndefinedAtomStereocenterCount:
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CatalogNumber: AI28897
ChemicalName: 3-(3-Fluorophenyl)-4H-1,2,4-triazole
CasNumber: 1279202-08-2
MolecularFormula: C8H6FN3
MolecularWeight: 163.1517
MdlNumber: MFCD18784762
Smiles: Fc1cccc(c1)c1n[nH]cn1
Complexity: 153
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
CatalogNumber:
AI28897
ChemicalName:
3-(3-Fluorophenyl)-4H-1,2,4-triazole
CasNumber:
1279202-08-2
MolecularFormula:
C8H6FN3
MolecularWeight:
163.1517
MdlNumber:
MFCD18784762
Smiles:
Fc1cccc(c1)c1n[nH]cn1
Complexity:
153
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__