AB42985
89985-87-5 | (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate
Manufacturer: A2B Chem
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CatalogNumber
AB42985
ChemicalName
(S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate
CasNumber
89985-87-5
MolecularFormula
C11H19NO4
MolecularWeight
229.2729
MdlNumber
MFCD13190790
Smiles
C=CC[C@@H](C(=O)OC)NC(=O)OC(C)(C)C
Complexity
268
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
7
Xlogp3
2
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CatalogNumber: AB42985
ChemicalName: (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate
CasNumber: 89985-87-5
MolecularFormula: C11H19NO4
MolecularWeight: 229.2729
MdlNumber: MFCD13190790
Smiles: C=CC[C@@H](C(=O)OC)NC(=O)OC(C)(C)C
Complexity: 268
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 7
Xlogp3: 2
CatalogNumber:
AB42985
ChemicalName:
(S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate
CasNumber:
89985-87-5
MolecularFormula:
C11H19NO4
MolecularWeight:
229.2729
MdlNumber:
MFCD13190790
Smiles:
C=CC[C@@H](C(=O)OC)NC(=O)OC(C)(C)C
Complexity:
268
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
7
Xlogp3:
2
CatalogNumber: AB42986
ChemicalName: (S)-Morpholin-3-ylmethanol, HCl
CasNumber: 218594-79-7
MolecularFormula: C5H12ClNO2
MolecularWeight: 153.6073
MdlNumber: MFCD12547468
Smiles: OC[C@H]1COCCN1.Cl
Complexity: 67.4
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB42986
ChemicalName:
(S)-Morpholin-3-ylmethanol, HCl
CasNumber:
218594-79-7
MolecularFormula:
C5H12ClNO2
MolecularWeight:
153.6073
MdlNumber:
MFCD12547468
Smiles:
OC[C@H]1COCCN1.Cl
Complexity:
67.4
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C([C@H]1NCc2c(C1)cccc2)NC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C([C@H]1NCc2c(C1)cccc2)NC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N[C@@H](c1ccccc1)CNC(=O)OC(C)(C)C
Complexity: 242
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@@H](c1ccccc1)CNC(=O)OC(C)(C)C
Complexity:
242
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5