AD47641

350488-79-8 | 4-Chloro-3-nitro-5-(trifluoromethyl)benzoic acid

Manufacturer: A2B Chem

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CatalogNumber

AD47641

ChemicalName

4-Chloro-3-nitro-5-(trifluoromethyl)benzoic acid

CasNumber

350488-79-8

MolecularFormula

C8H3ClF3NO4

MolecularWeight

269.5619

MdlNumber

MFCD04972737

Smiles

OC(=O)c1cc([N+](=O)[O-])c(c(c1)C(F)(F)F)Cl

Complexity

330

Covalently-bondedUnitCount

1

HeavyAtomCount

17

HydrogenBondAcceptorCount

7

HydrogenBondDonorCount

1

RotatableBondCount

1

Xlogp3

2.8

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A2B Chem

AD47641

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CatalogNumber:
AD47641

ChemicalName:
4-Chloro-3-nitro-5-(trifluoromethyl)benzoic acid

CasNumber:
350488-79-8

MolecularFormula:
C8H3ClF3NO4

MolecularWeight:
269.5619

MdlNumber:
MFCD04972737

Smiles:
OC(=O)c1cc([N+](=O)[O-])c(c(c1)C(F)(F)F)Cl

Complexity:
330

Covalently-bondedUnitCount:
1

HeavyAtomCount:
17

HydrogenBondAcceptorCount:
7

HydrogenBondDonorCount:
1

RotatableBondCount:
1

Xlogp3:
2.8

Img

A2B Chem

AD47647

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CNCc1cc(ccc1O)[N+](=O)[O-]

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AD47648

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
Cn1cccc1c1ccncc1

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AD47653

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
O=c1oc2ccccc2c(c1C(c1c(=O)oc2c(c1O)cccc2)c1cccnc1)O

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__