AB56161
37675-18-6 | (S)-(+)-Nipecotic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB56161
ChemicalName
(S)-(+)-Nipecotic acid ethyl ester
CasNumber
37675-18-6
MolecularFormula
C8H15NO2
MolecularWeight
157.2102
MdlNumber
MFCD00792499
Smiles
CCOC(=O)[C@H]1CCCNC1
Complexity
136
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.1
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CatalogNumber: AB56161
ChemicalName: (S)-(+)-Nipecotic acid ethyl ester
CasNumber: 37675-18-6
MolecularFormula: C8H15NO2
MolecularWeight: 157.2102
MdlNumber: MFCD00792499
Smiles: CCOC(=O)[C@H]1CCCNC1
Complexity: 136
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.1
CatalogNumber:
AB56161
ChemicalName:
(S)-(+)-Nipecotic acid ethyl ester
CasNumber:
37675-18-6
MolecularFormula:
C8H15NO2
MolecularWeight:
157.2102
MdlNumber:
MFCD00792499
Smiles:
CCOC(=O)[C@H]1CCCNC1
Complexity:
136
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.1
CatalogNumber: AB56162
ChemicalName: Fmoc-(s)-3-amino-4-(3-methyl-phenyl)-butyric acid
CasNumber: 270062-94-7
MolecularFormula: C26H25NO4
MolecularWeight: 415.481
MdlNumber: MFCD01861024
Smiles: O=C(N[C@@H](Cc1cccc(c1)C)CC(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity: 601
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 8
Xlogp3: 4.9
CatalogNumber:
AB56162
ChemicalName:
Fmoc-(s)-3-amino-4-(3-methyl-phenyl)-butyric acid
CasNumber:
270062-94-7
MolecularFormula:
C26H25NO4
MolecularWeight:
415.481
MdlNumber:
MFCD01861024
Smiles:
O=C(N[C@@H](Cc1cccc(c1)C)CC(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity:
601
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
8
Xlogp3:
4.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C[C@@H](C(c1ccccc1)c1ccccc1)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C[C@@H](C(c1ccccc1)c1ccccc1)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB56164
ChemicalName: (S)-(-)-Indoline-2-carboxylic acid
CasNumber: 79815-20-6
MolecularFormula: C9H9NO2
MolecularWeight: 163.1733
MdlNumber: MFCD00070578
Smiles: OC(=O)[C@@H]1Cc2c(N1)cccc2
Complexity: 193
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AB56164
ChemicalName:
(S)-(-)-Indoline-2-carboxylic acid
CasNumber:
79815-20-6
MolecularFormula:
C9H9NO2
MolecularWeight:
163.1733
MdlNumber:
MFCD00070578
Smiles:
OC(=O)[C@@H]1Cc2c(N1)cccc2
Complexity:
193
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.6