AB49999

19362-77-7 | 4,4'-Thiobisbenzenethiol

Manufacturer: A2B Chem

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CatalogNumber

AB49999

ChemicalName

4,4'-Thiobisbenzenethiol

CasNumber

19362-77-7

MolecularFormula

C12H10S3

MolecularWeight

250.4028

MdlNumber

MFCD00142119

Smiles

Sc1ccc(cc1)Sc1ccc(cc1)S

Complexity

159

Covalently-bondedUnitCount

1

HeavyAtomCount

15

HydrogenBondAcceptorCount

3

HydrogenBondDonorCount

2

RotatableBondCount

2

Xlogp3

4.4

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A2B Chem

AB49999

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CatalogNumber:
AB49999

ChemicalName:
4,4'-Thiobisbenzenethiol

CasNumber:
19362-77-7

MolecularFormula:
C12H10S3

MolecularWeight:
250.4028

MdlNumber:
MFCD00142119

Smiles:
Sc1ccc(cc1)Sc1ccc(cc1)S

Complexity:
159

Covalently-bondedUnitCount:
1

HeavyAtomCount:
15

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
2

RotatableBondCount:
2

Xlogp3:
4.4

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A2B Chem

AB50000

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CatalogNumber:
AB50000

ChemicalName:
Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate

CasNumber:
1188911-72-9

MolecularFormula:
C6H9F3O2

MolecularWeight:
170.1297

MdlNumber:
MFCD18253569

Smiles:
COC(=O)C(C(F)(F)F)(C)C

Complexity:
160

Covalently-bondedUnitCount:
1

HeavyAtomCount:
11

HydrogenBondAcceptorCount:
5

HydrogenBondDonorCount:
__

RotatableBondCount:
2

Xlogp3:
2.1

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AB50001

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CCOC(=O)C=C1CCN(CC1)Cc1ccccc1

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
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Xlogp3:
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A2B Chem

AB50002

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
[O-][N+](=O)c1cc(ccc1N)C(F)(F)F

Complexity:
226

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
2