AB45054
619-44-3 | Methyl 4-iodobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB45054
ChemicalName
Methyl 4-iodobenzoate
CasNumber
619-44-3
MolecularFormula
C8H7IO2
MolecularWeight
262.0444
MdlNumber
MFCD00016353
Smiles
COC(=O)c1ccc(cc1)I
NscNumber
9393
Complexity
139
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
3
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CatalogNumber: AB45054
ChemicalName: Methyl 4-iodobenzoate
CasNumber: 619-44-3
MolecularFormula: C8H7IO2
MolecularWeight: 262.0444
MdlNumber: MFCD00016353
Smiles: COC(=O)c1ccc(cc1)I
NscNumber: 9393
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AB45054
ChemicalName:
Methyl 4-iodobenzoate
CasNumber:
619-44-3
MolecularFormula:
C8H7IO2
MolecularWeight:
262.0444
MdlNumber:
MFCD00016353
Smiles:
COC(=O)c1ccc(cc1)I
NscNumber:
9393
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3
CatalogNumber: AB45055
ChemicalName: 4-Iodobenzotrifluoride
CasNumber: 455-13-0
MolecularFormula: C7H4F3I
MolecularWeight: 272.0063
MdlNumber: MFCD00039398
Smiles: FC(c1ccc(cc1)I)(F)F
NscNumber: __
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 3.6
CatalogNumber:
AB45055
ChemicalName:
4-Iodobenzotrifluoride
CasNumber:
455-13-0
MolecularFormula:
C7H4F3I
MolecularWeight:
272.0063
MdlNumber:
MFCD00039398
Smiles:
FC(c1ccc(cc1)I)(F)F
NscNumber:
__
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
3.6
CatalogNumber: AB45056
ChemicalName: 4-Iodoimidazole
CasNumber: 71759-89-2
MolecularFormula: C3H3IN2
MolecularWeight: 193.9738
MdlNumber: MFCD01632213
Smiles: Ic1c[nH]cn1
NscNumber: __
Complexity: 48.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
Xlogp3: 0.5
CatalogNumber:
AB45056
ChemicalName:
4-Iodoimidazole
CasNumber:
71759-89-2
MolecularFormula:
C3H3IN2
MolecularWeight:
193.9738
MdlNumber:
MFCD01632213
Smiles:
Ic1c[nH]cn1
NscNumber:
__
Complexity:
48.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
Xlogp3:
0.5
CatalogNumber: AB45057
ChemicalName: 4-Iodophenylboronic acid
CasNumber: 5122-99-6
MolecularFormula: C6H6BIO2
MolecularWeight: 247.8261
MdlNumber: MFCD01319014
Smiles: OB(c1ccc(cc1)I)O
NscNumber: __
Complexity: 102
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB45057
ChemicalName:
4-Iodophenylboronic acid
CasNumber:
5122-99-6
MolecularFormula:
C6H6BIO2
MolecularWeight:
247.8261
MdlNumber:
MFCD01319014
Smiles:
OB(c1ccc(cc1)I)O
NscNumber:
__
Complexity:
102
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
__