AB48391
952182-03-5 | N-Methyl-3-oxetanamine
Manufacturer: A2B Chem
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CatalogNumber
AB48391
ChemicalName
N-Methyl-3-oxetanamine
CasNumber
952182-03-5
MolecularFormula
C4H9NO
MolecularWeight
87.1204
MdlNumber
MFCD08544349
Smiles
CNC1COC1
Complexity
42.8
Covalently-bondedUnitCount
1
HeavyAtomCount
6
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
-0.5
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CatalogNumber: AB48391
ChemicalName: N-Methyl-3-oxetanamine
CasNumber: 952182-03-5
MolecularFormula: C4H9NO
MolecularWeight: 87.1204
MdlNumber: MFCD08544349
Smiles: CNC1COC1
Complexity: 42.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.5
CatalogNumber:
AB48391
ChemicalName:
N-Methyl-3-oxetanamine
CasNumber:
952182-03-5
MolecularFormula:
C4H9NO
MolecularWeight:
87.1204
MdlNumber:
MFCD08544349
Smiles:
CNC1COC1
Complexity:
42.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.5
CatalogNumber: AB48392
ChemicalName: Methyloxalacetic acid diethyl ester
CasNumber: 759-65-9
MolecularFormula: C9H14O5
MolecularWeight: 202.2045
MdlNumber: MFCD00009163
Smiles: CCOC(=O)C(=O)C(C(=O)OCC)C
Complexity: 233
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 7
Xlogp3: 1.3
CatalogNumber:
AB48392
ChemicalName:
Methyloxalacetic acid diethyl ester
CasNumber:
759-65-9
MolecularFormula:
C9H14O5
MolecularWeight:
202.2045
MdlNumber:
MFCD00009163
Smiles:
CCOC(=O)C(=O)C(C(=O)OCC)C
Complexity:
233
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
7
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O/N=C(/c1ccccc1)\Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O/N=C(/c1ccccc1)\Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48394
ChemicalName: 1-Oxaspiro[4.5]decan-2-one
CasNumber: 699-61-6
MolecularFormula: C9H14O2
MolecularWeight: 154.2063
MdlNumber: MFCD00459846
Smiles: O=C1CCC2(O1)CCCCC2
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
AB48394
ChemicalName:
1-Oxaspiro[4.5]decan-2-one
CasNumber:
699-61-6
MolecularFormula:
C9H14O2
MolecularWeight:
154.2063
MdlNumber:
MFCD00459846
Smiles:
O=C1CCC2(O1)CCCCC2
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8