AE31955
1131622-56-4 | Methyl 3-bromo-4-morpholinobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AE31955
ChemicalName
Methyl 3-bromo-4-morpholinobenzoate
CasNumber
1131622-56-4
MolecularFormula
C12H14BrNO3
MolecularWeight
300.1485
MdlNumber
MFCD11113011
Smiles
COC(=O)c1ccc(c(c1)Br)N1CCOCC1
Complexity
269
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.2
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CatalogNumber: AE31955
ChemicalName: Methyl 3-bromo-4-morpholinobenzoate
CasNumber: 1131622-56-4
MolecularFormula: C12H14BrNO3
MolecularWeight: 300.1485
MdlNumber: MFCD11113011
Smiles: COC(=O)c1ccc(c(c1)Br)N1CCOCC1
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AE31955
ChemicalName:
Methyl 3-bromo-4-morpholinobenzoate
CasNumber:
1131622-56-4
MolecularFormula:
C12H14BrNO3
MolecularWeight:
300.1485
MdlNumber:
MFCD11113011
Smiles:
COC(=O)c1ccc(c(c1)Br)N1CCOCC1
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.2
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Smiles: N[C@@H](C(F)(F)F)C1CC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
N[C@@H](C(F)(F)F)C1CC1
Complexity:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COC(=O)c1cnn(c1C(=O)O)C
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Smiles:
COC(=O)c1cnn(c1C(=O)O)C
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Fc1ccc(nc1C)c1[nH]c(=N)[nH]c1c1ccc2c(c1)nccn2
Complexity: __
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Smiles:
Fc1ccc(nc1C)c1[nH]c(=N)[nH]c1c1ccc2c(c1)nccn2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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