AF59353
357610-31-2 | N-Boc-beta-alanine-beta-methyl-n-carboxyanhydride
Manufacturer: A2B Chem
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CatalogNumber
AF59353
ChemicalName
N-Boc-beta-alanine-beta-methyl-n-carboxyanhydride
CasNumber
357610-31-2
MolecularFormula
C10H15NO5
MolecularWeight
229.2298
MdlNumber
MFCD03839892
Smiles
O=C1CC(C)N(C(=O)O1)C(=O)OC(C)(C)C
Complexity
331
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.2
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CatalogNumber: AF59353
ChemicalName: N-Boc-beta-alanine-beta-methyl-n-carboxyanhydride
CasNumber: 357610-31-2
MolecularFormula: C10H15NO5
MolecularWeight: 229.2298
MdlNumber: MFCD03839892
Smiles: O=C1CC(C)N(C(=O)O1)C(=O)OC(C)(C)C
Complexity: 331
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.2
CatalogNumber:
AF59353
ChemicalName:
N-Boc-beta-alanine-beta-methyl-n-carboxyanhydride
CasNumber:
357610-31-2
MolecularFormula:
C10H15NO5
MolecularWeight:
229.2298
MdlNumber:
MFCD03839892
Smiles:
O=C1CC(C)N(C(=O)O1)C(=O)OC(C)(C)C
Complexity:
331
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CC(C1CCCN(C1)C(=O)OC(C)(C)C)NC(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CC(C1CCCN(C1)C(=O)OC(C)(C)C)NC(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AF59355
ChemicalName: Ethyl 1,3-benzothiazole-2-carboxylate
CasNumber: 32137-76-1
MolecularFormula: C10H9NO2S
MolecularWeight: 207.249
MdlNumber: MFCD00848360
Smiles: CCOC(=O)c1nc2c(s1)cccc2
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 2.9
CatalogNumber:
AF59355
ChemicalName:
Ethyl 1,3-benzothiazole-2-carboxylate
CasNumber:
32137-76-1
MolecularFormula:
C10H9NO2S
MolecularWeight:
207.249
MdlNumber:
MFCD00848360
Smiles:
CCOC(=O)c1nc2c(s1)cccc2
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1[nH]c(c(c1C)C(=O)OC(C)(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1[nH]c(c(c1C)C(=O)OC(C)(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__