AD56433
135782-19-3 | methyl morpholine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD56433
ChemicalName
methyl morpholine-2-carboxylate
CasNumber
135782-19-3
MolecularFormula
C6H11NO3
MolecularWeight
145.1564
MdlNumber
MFCD11656588
Smiles
COC(=O)C1CNCCO1
Complexity
126
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
-0.6
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CatalogNumber: AD56433
ChemicalName: methyl morpholine-2-carboxylate
CasNumber: 135782-19-3
MolecularFormula: C6H11NO3
MolecularWeight: 145.1564
MdlNumber: MFCD11656588
Smiles: COC(=O)C1CNCCO1
Complexity: 126
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.6
CatalogNumber:
AD56433
ChemicalName:
methyl morpholine-2-carboxylate
CasNumber:
135782-19-3
MolecularFormula:
C6H11NO3
MolecularWeight:
145.1564
MdlNumber:
MFCD11656588
Smiles:
COC(=O)C1CNCCO1
Complexity:
126
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COCc1c(C)c(COC)c(c(c1C)C=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
COCc1c(C)c(COC)c(c(c1C)C=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: ClCCc1ccc2c(c1)OCO2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
ClCCc1ccc2c(c1)OCO2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: O=C(N[C@H](C(=O)Nc1ccc2c(c1)oc(=O)cc2C)CC(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N[C@H](C(=O)Nc1ccc2c(c1)oc(=O)cc2C)CC(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__