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AI50356

43076-61-5 | 1-(4-(tert-Butyl)phenyl)-4-chlorobutan-1-one

Manufacturer: A2B Chem

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CatalogNumber

AI50356

ChemicalName

1-(4-(tert-Butyl)phenyl)-4-chlorobutan-1-one

CasNumber

43076-61-5

MolecularFormula

C14H19ClO

MolecularWeight

238.7531

MdlNumber

MFCD00018996

Smiles

ClCCCC(=O)c1ccc(cc1)C(C)(C)C

Complexity

221

Covalently-bondedUnitCount

1

HeavyAtomCount

16

HydrogenBondAcceptorCount

1

RotatableBondCount

5

Xlogp3

4.2

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Img

A2B Chem

AI50356

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CatalogNumber:
AI50356
ChemicalName:
1-(4-(tert-Butyl)phenyl)-4-chlorobutan-1-one
CasNumber:
43076-61-5
MolecularFormula:
C14H19ClO
MolecularWeight:
238.7531
MdlNumber:
MFCD00018996
Smiles:
ClCCCC(=O)c1ccc(cc1)C(C)(C)C
Complexity:
221
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
1
RotatableBondCount:
5
Xlogp3:
4.2

Img

A2B Chem

AI50357

--

CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CN(C(=O)C1)c1cccc(c1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__

Img

A2B Chem

AI50358

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CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCC(C(F)(F)F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__

Img

A2B Chem

AI50359

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CatalogNumber:
AI50359
ChemicalName:
Methyl 2,2,2-trifluoroacetate
CasNumber:
431-47-0
MolecularFormula:
C3H3F3O2
MolecularWeight:
128.04992959999998
MdlNumber:
MFCD00000417
Smiles:
COC(=O)C(F)(F)F
Complexity:
95.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
0.6