AI56524
795299-77-3 | 2-(Azetidin-1-yl)ethan-1-amine
Manufacturer: A2B Chem
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CatalogNumber
AI56524
ChemicalName
2-(Azetidin-1-yl)ethan-1-amine
CasNumber
795299-77-3
MolecularFormula
C5H12N2
MolecularWeight
100.1622
MdlNumber
MFCD19205720
Smiles
NCCN1CCC1
Complexity
50
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
-0.3
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CatalogNumber: AI56524
ChemicalName: 2-(Azetidin-1-yl)ethan-1-amine
CasNumber: 795299-77-3
MolecularFormula: C5H12N2
MolecularWeight: 100.1622
MdlNumber: MFCD19205720
Smiles: NCCN1CCC1
Complexity: 50
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: -0.3
CatalogNumber:
AI56524
ChemicalName:
2-(Azetidin-1-yl)ethan-1-amine
CasNumber:
795299-77-3
MolecularFormula:
C5H12N2
MolecularWeight:
100.1622
MdlNumber:
MFCD19205720
Smiles:
NCCN1CCC1
Complexity:
50
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
-0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC1CC2C(C1)C2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC1CC2C(C1)C2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1=C(C(=C(C(=C1F)F)F)F)CO
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1=C(C(=C(C(=C1F)F)F)F)CO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI56527
ChemicalName: Methyl 2,4,6-trifluorobenzoate
CasNumber: 79538-28-6
MolecularFormula: C8H5F3O2
MolecularWeight: 190.1193
MdlNumber: MFCD01090991
Smiles: COC(=O)c1c(F)cc(cc1F)F
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AI56527
ChemicalName:
Methyl 2,4,6-trifluorobenzoate
CasNumber:
79538-28-6
MolecularFormula:
C8H5F3O2
MolecularWeight:
190.1193
MdlNumber:
MFCD01090991
Smiles:
COC(=O)c1c(F)cc(cc1F)F
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.1