AE18774
1159598-86-3 | 4-Methyl-3-(hydroxymethyl)morpholine
Manufacturer: A2B Chem
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CatalogNumber
AE18774
ChemicalName
4-Methyl-3-(hydroxymethyl)morpholine
CasNumber
1159598-86-3
MolecularFormula
C6H13NO2
MolecularWeight
131.17291999999998
MdlNumber
MFCD26792530
Smiles
CN1CCOCC1CO
Complexity
87.1
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
-0.7
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CatalogNumber: AE18774
ChemicalName: 4-Methyl-3-(hydroxymethyl)morpholine
CasNumber: 1159598-86-3
MolecularFormula: C6H13NO2
MolecularWeight: 131.17291999999998
MdlNumber: MFCD26792530
Smiles: CN1CCOCC1CO
Complexity: 87.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.7
CatalogNumber:
AE18774
ChemicalName:
4-Methyl-3-(hydroxymethyl)morpholine
CasNumber:
1159598-86-3
MolecularFormula:
C6H13NO2
MolecularWeight:
131.17291999999998
MdlNumber:
MFCD26792530
Smiles:
CN1CCOCC1CO
Complexity:
87.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.7
CatalogNumber: AE18775
ChemicalName: 5-Nitro-6-(trifluoromethyl)pyridin-2-ol
CasNumber: 117519-19-4
MolecularFormula: C6H3F3N2O3
MolecularWeight: 208.0948
MdlNumber: MFCD11616333
Smiles: [O-][N+](=O)c1ccc(=O)[nH]c1C(F)(F)F
Complexity: 350
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 0.6
CatalogNumber:
AE18775
ChemicalName:
5-Nitro-6-(trifluoromethyl)pyridin-2-ol
CasNumber:
117519-19-4
MolecularFormula:
C6H3F3N2O3
MolecularWeight:
208.0948
MdlNumber:
MFCD11616333
Smiles:
[O-][N+](=O)c1ccc(=O)[nH]c1C(F)(F)F
Complexity:
350
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1sc2c(c1)C(=O)NCC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1sc2c(c1)C(=O)NCC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AE18778
ChemicalName: tert-Butyl 5-amino-3-methyl-1h-pyrazole-1-carboxylate
CasNumber: 1065204-79-6
MolecularFormula: C9H15N3O2
MolecularWeight: 197.2343
MdlNumber: MFCD11656647
Smiles: Cc1nn(c(c1)N)C(=O)OC(C)(C)C
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 2.1
CatalogNumber:
AE18778
ChemicalName:
tert-Butyl 5-amino-3-methyl-1h-pyrazole-1-carboxylate
CasNumber:
1065204-79-6
MolecularFormula:
C9H15N3O2
MolecularWeight:
197.2343
MdlNumber:
MFCD11656647
Smiles:
Cc1nn(c(c1)N)C(=O)OC(C)(C)C
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.1