AA72394
144688-70-0 | tert-Butyl 2-cyanopyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA72394
ChemicalName
tert-Butyl 2-cyanopyrrolidine-1-carboxylate
CasNumber
144688-70-0
MolecularFormula
C10H16N2O2
MolecularWeight
196.2462
MdlNumber
MFCD01861225
Smiles
N#CC1CCCN1C(=O)OC(C)(C)C
Complexity
272
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.4
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CatalogNumber: AA72394
ChemicalName: tert-Butyl 2-cyanopyrrolidine-1-carboxylate
CasNumber: 144688-70-0
MolecularFormula: C10H16N2O2
MolecularWeight: 196.2462
MdlNumber: MFCD01861225
Smiles: N#CC1CCCN1C(=O)OC(C)(C)C
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.4
CatalogNumber:
AA72394
ChemicalName:
tert-Butyl 2-cyanopyrrolidine-1-carboxylate
CasNumber:
144688-70-0
MolecularFormula:
C10H16N2O2
MolecularWeight:
196.2462
MdlNumber:
MFCD01861225
Smiles:
N#CC1CCCN1C(=O)OC(C)(C)C
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1CCCN1C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC1CCCN1C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCCCCc1ccc(cc1)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCCCCc1ccc(cc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AA72399
ChemicalName: (5-Bromopentyl)benzene
CasNumber: 14469-83-1
MolecularFormula: C11H15Br
MolecularWeight: 227.1408
MdlNumber: MFCD00623213
Smiles: BrCCCCCc1ccccc1
Complexity: 95.2
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: __
RotatableBondCount: 5
UndefinedAtomStereocenterCount: __
Xlogp3: 4.2
CatalogNumber:
AA72399
ChemicalName:
(5-Bromopentyl)benzene
CasNumber:
14469-83-1
MolecularFormula:
C11H15Br
MolecularWeight:
227.1408
MdlNumber:
MFCD00623213
Smiles:
BrCCCCCc1ccccc1
Complexity:
95.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
__
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
__
Xlogp3:
4.2