AB75586
77317-55-6 | Methyl 2-amino-5-iodobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB75586
ChemicalName
Methyl 2-amino-5-iodobenzoate
CasNumber
77317-55-6
MolecularFormula
C8H8INO2
MolecularWeight
277.0591
MdlNumber
MFCD00798574
Smiles
COC(=O)c1cc(I)ccc1N
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AB75586
ChemicalName: Methyl 2-amino-5-iodobenzoate
CasNumber: 77317-55-6
MolecularFormula: C8H8INO2
MolecularWeight: 277.0591
MdlNumber: MFCD00798574
Smiles: COC(=O)c1cc(I)ccc1N
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB75586
ChemicalName:
Methyl 2-amino-5-iodobenzoate
CasNumber:
77317-55-6
MolecularFormula:
C8H8INO2
MolecularWeight:
277.0591
MdlNumber:
MFCD00798574
Smiles:
COC(=O)c1cc(I)ccc1N
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(C)ccc1N
Complexity: 170
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(C)ccc1N
Complexity:
170
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1c(N)cccc1[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1c(N)cccc1[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB75589
ChemicalName: Methyl 2-aminothiazole-5-carboxylate
CasNumber: 6633-61-0
MolecularFormula: C5H6N2O2S
MolecularWeight: 158.1783
MdlNumber: MFCD03788562
Smiles: COC(=O)c1cnc(s1)N
Complexity: 142
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AB75589
ChemicalName:
Methyl 2-aminothiazole-5-carboxylate
CasNumber:
6633-61-0
MolecularFormula:
C5H6N2O2S
MolecularWeight:
158.1783
MdlNumber:
MFCD03788562
Smiles:
COC(=O)c1cnc(s1)N
Complexity:
142
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.8