AB68566
183741-86-8 | 5-(tert-Butoxycarbonylamino)-2-methoxypyridine-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB68566
ChemicalName
5-(tert-Butoxycarbonylamino)-2-methoxypyridine-4-carboxylic acid
CasNumber
183741-86-8
MolecularFormula
C12H16N2O5
MolecularWeight
268.26583999999997
MdlNumber
MFCD07437869
Smiles
COc1ncc(c(c1)C(=O)O)NC(=O)OC(C)(C)C
Complexity
340
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
1.8
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CatalogNumber: AB68566
ChemicalName: 5-(tert-Butoxycarbonylamino)-2-methoxypyridine-4-carboxylic acid
CasNumber: 183741-86-8
MolecularFormula: C12H16N2O5
MolecularWeight: 268.26583999999997
MdlNumber: MFCD07437869
Smiles: COc1ncc(c(c1)C(=O)O)NC(=O)OC(C)(C)C
Complexity: 340
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 1.8
CatalogNumber:
AB68566
ChemicalName:
5-(tert-Butoxycarbonylamino)-2-methoxypyridine-4-carboxylic acid
CasNumber:
183741-86-8
MolecularFormula:
C12H16N2O5
MolecularWeight:
268.26583999999997
MdlNumber:
MFCD07437869
Smiles:
COc1ncc(c(c1)C(=O)O)NC(=O)OC(C)(C)C
Complexity:
340
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
1.8
CatalogNumber: AB68567
ChemicalName: 5-(Boc-amino)-1-pentanol
CasNumber: 75178-90-4
MolecularFormula: C10H21NO3
MolecularWeight: 203.2786
MdlNumber: MFCD01862955
Smiles: OCCCCCNC(=O)OC(C)(C)C
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 1.3
CatalogNumber:
AB68567
ChemicalName:
5-(Boc-amino)-1-pentanol
CasNumber:
75178-90-4
MolecularFormula:
C10H21NO3
MolecularWeight:
203.2786
MdlNumber:
MFCD01862955
Smiles:
OCCCCCNC(=O)OC(C)(C)C
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1cc(cc(c1O)C=O)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cc(cc(c1O)C=O)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB68569
ChemicalName: 4-tert-Butylphthalic anhydride
CasNumber: 32703-79-0
MolecularFormula: C12H12O3
MolecularWeight: 204.2219
MdlNumber: MFCD00060127
Smiles: O=C1OC(=O)c2c1cc(cc2)C(C)(C)C
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AB68569
ChemicalName:
4-tert-Butylphthalic anhydride
CasNumber:
32703-79-0
MolecularFormula:
C12H12O3
MolecularWeight:
204.2219
MdlNumber:
MFCD00060127
Smiles:
O=C1OC(=O)c2c1cc(cc2)C(C)(C)C
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
3