AV18745
909563-22-0 | Methyl 4-amino-2-isopropoxybenzoate
Manufacturer: A2B Chem
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CatalogNumber
AV18745
ChemicalName
Methyl 4-amino-2-isopropoxybenzoate
CasNumber
909563-22-0
MolecularFormula
C11H15NO3
MolecularWeight
209.2417
MdlNumber
MFCD24624427
Smiles
COC(=O)c1ccc(cc1OC(C)C)N
Complexity
218
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.7
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CatalogNumber: AV18745
ChemicalName: Methyl 4-amino-2-isopropoxybenzoate
CasNumber: 909563-22-0
MolecularFormula: C11H15NO3
MolecularWeight: 209.2417
MdlNumber: MFCD24624427
Smiles: COC(=O)c1ccc(cc1OC(C)C)N
Complexity: 218
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.7
CatalogNumber:
AV18745
ChemicalName:
Methyl 4-amino-2-isopropoxybenzoate
CasNumber:
909563-22-0
MolecularFormula:
C11H15NO3
MolecularWeight:
209.2417
MdlNumber:
MFCD24624427
Smiles:
COC(=O)c1ccc(cc1OC(C)C)N
Complexity:
218
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccc(c(c1)F)Br)NCc1ccccc1
Complexity: 281
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccc(c(c1)F)Br)NCc1ccccc1
Complexity:
281
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCc1cc(C)[nH]c(=O)c1CN.Cl
Complexity: 277
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCc1cc(C)[nH]c(=O)c1CN.Cl
Complexity:
277
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)[C@H]1Oc2c([C@H]1c1cc(OC)cc(c1)OC)cc(cc2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)[C@H]1Oc2c([C@H]1c1cc(OC)cc(c1)OC)cc(cc2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__