AB61961

1257739-16-4 | 2-(6-Methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)benzonitrile

Manufacturer: A2B Chem

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CatalogNumber

AB61961

ChemicalName

2-(6-Methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)benzonitrile

CasNumber

1257739-16-4

MolecularFormula

C12H11BN2O4

MolecularWeight

258.0377

MdlNumber

MFCD12546009

Smiles

N#Cc1ccccc1B1OC(=O)CN(CC(=O)O1)C

Complexity

399

Covalently-bondedUnitCount

1

HeavyAtomCount

19

HydrogenBondAcceptorCount

6

RotatableBondCount

1

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A2B Chem

AB61961

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CatalogNumber:
AB61961

ChemicalName:
2-(6-Methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)benzonitrile

CasNumber:
1257739-16-4

MolecularFormula:
C12H11BN2O4

MolecularWeight:
258.0377

MdlNumber:
MFCD12546009

Smiles:
N#Cc1ccccc1B1OC(=O)CN(CC(=O)O1)C

Complexity:
399

Covalently-bondedUnitCount:
1

HeavyAtomCount:
19

HydrogenBondAcceptorCount:
6

RotatableBondCount:
1

Img

A2B Chem

AB61962

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CatalogNumber:
AB61962

ChemicalName:
2-Cyclobutyl-1h-imidazole

CasNumber:
89943-00-0

MolecularFormula:
C7H10N2

MolecularWeight:
122.1677

MdlNumber:
MFCD19221449

Smiles:
C1CC(C1)c1ncc[nH]1

Complexity:
99.1

Covalently-bondedUnitCount:
1

HeavyAtomCount:
9

HydrogenBondAcceptorCount:
1

RotatableBondCount:
1

Img

A2B Chem

AB61963

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CatalogNumber:
AB61963

ChemicalName:
2-Cyclohexen-1-ol

CasNumber:
822-67-3

MolecularFormula:
C6H10O

MolecularWeight:
98.143

MdlNumber:
MFCD00001570

Smiles:
OC1CCCC=C1

Complexity:
76.2

Covalently-bondedUnitCount:
1

HeavyAtomCount:
7

HydrogenBondAcceptorCount:
1

RotatableBondCount:
__

Img

A2B Chem

AB61964

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CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC1(OC)CCCC=C1

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

RotatableBondCount:
__