AA91690
173435-78-4 | 9-((tert-Butoxycarbonyl)amino)nonanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA91690
ChemicalName
9-((tert-Butoxycarbonyl)amino)nonanoic acid
CasNumber
173435-78-4
MolecularFormula
C14H27NO4
MolecularWeight
273.3685
MdlNumber
MFCD02092968
Smiles
OC(=O)CCCCCCCCNC(=O)OC(C)(C)C
Complexity
271
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
11
Xlogp3
3.1
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CatalogNumber: AA91690
ChemicalName: 9-((tert-Butoxycarbonyl)amino)nonanoic acid
CasNumber: 173435-78-4
MolecularFormula: C14H27NO4
MolecularWeight: 273.3685
MdlNumber: MFCD02092968
Smiles: OC(=O)CCCCCCCCNC(=O)OC(C)(C)C
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 11
Xlogp3: 3.1
CatalogNumber:
AA91690
ChemicalName:
9-((tert-Butoxycarbonyl)amino)nonanoic acid
CasNumber:
173435-78-4
MolecularFormula:
C14H27NO4
MolecularWeight:
273.3685
MdlNumber:
MFCD02092968
Smiles:
OC(=O)CCCCCCCCNC(=O)OC(C)(C)C
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
11
Xlogp3:
3.1
CatalogNumber: AA91692
ChemicalName: Methyl 3-amino-2-chloroisonicotinate
CasNumber: 173435-41-1
MolecularFormula: C7H7ClN2O2
MolecularWeight: 186.5957
MdlNumber: MFCD03411723
Smiles: COC(=O)c1ccnc(c1N)Cl
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AA91692
ChemicalName:
Methyl 3-amino-2-chloroisonicotinate
CasNumber:
173435-41-1
MolecularFormula:
C7H7ClN2O2
MolecularWeight:
186.5957
MdlNumber:
MFCD03411723
Smiles:
COC(=O)c1ccnc(c1N)Cl
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
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Smiles: COc1ccnc(c1N)Cl
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1ccnc(c1N)Cl
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Cc1cnc(c(c1)N)F
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Cc1cnc(c(c1)N)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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