AC20014

872624-52-7 | Methyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate

Manufacturer: A2B Chem

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CatalogNumber

AC20014

ChemicalName

Methyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate

CasNumber

872624-52-7

MolecularFormula

C9H7F3INO2

MolecularWeight

345.05705959999995

MdlNumber

MFCD11111107

Smiles

COC(=O)c1cc(I)c(cc1N)C(F)(F)F

Complexity

272

Covalently-bondedUnitCount

1

HeavyAtomCount

16

HydrogenBondAcceptorCount

6

HydrogenBondDonorCount

1

RotatableBondCount

2

Xlogp3

3.2

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A2B Chem

AC20014

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CatalogNumber:
AC20014

ChemicalName:
Methyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate

CasNumber:
872624-52-7

MolecularFormula:
C9H7F3INO2

MolecularWeight:
345.05705959999995

MdlNumber:
MFCD11111107

Smiles:
COC(=O)c1cc(I)c(cc1N)C(F)(F)F

Complexity:
272

Covalently-bondedUnitCount:
1

HeavyAtomCount:
16

HydrogenBondAcceptorCount:
6

HydrogenBondDonorCount:
1

RotatableBondCount:
2

Xlogp3:
3.2

Img

A2B Chem

AC20019

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc2ccccc2c1[N+](=O)[O-]

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

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A2B Chem

AC20029

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CC(OC(=O)OC(I)C)C

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AC20030

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
NCCN(CCN(CCO)CCO)CCO

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__