AE66566
1357280-81-9 | Ethyl 4-amino-1-methylcyclohexane-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE66566
ChemicalName
Ethyl 4-amino-1-methylcyclohexane-1-carboxylate
CasNumber
1357280-81-9
MolecularFormula
C10H19NO2
MolecularWeight
185.2634
MdlNumber
MFCD24644340
Smiles
CCOC(=O)C1(C)CCC(CC1)N
Complexity
183
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.1
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CatalogNumber: AE66566
ChemicalName: Ethyl 4-amino-1-methylcyclohexane-1-carboxylate
CasNumber: 1357280-81-9
MolecularFormula: C10H19NO2
MolecularWeight: 185.2634
MdlNumber: MFCD24644340
Smiles: CCOC(=O)C1(C)CCC(CC1)N
Complexity: 183
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AE66566
ChemicalName:
Ethyl 4-amino-1-methylcyclohexane-1-carboxylate
CasNumber:
1357280-81-9
MolecularFormula:
C10H19NO2
MolecularWeight:
185.2634
MdlNumber:
MFCD24644340
Smiles:
CCOC(=O)C1(C)CCC(CC1)N
Complexity:
183
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)Cc1cccc2c1cn[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cc1cccc2c1cn[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE66568
ChemicalName: Methyl 2-bromo-4,6-difluorobenzoate
CasNumber: 1379336-54-5
MolecularFormula: C8H5BrF2O2
MolecularWeight: 251.0249
MdlNumber: MFCD18642939
Smiles: COC(=O)c1c(F)cc(cc1Br)F
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AE66568
ChemicalName:
Methyl 2-bromo-4,6-difluorobenzoate
CasNumber:
1379336-54-5
MolecularFormula:
C8H5BrF2O2
MolecularWeight:
251.0249
MdlNumber:
MFCD18642939
Smiles:
COC(=O)c1c(F)cc(cc1Br)F
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AE66569
ChemicalName: Methyl 3'-methyl[1,1'-biphenyl]-3-carboxylate
CasNumber: 128460-74-2
MolecularFormula: C15H14O2
MolecularWeight: 226.27046
MdlNumber: MFCD05979105
Smiles: COC(=O)c1cccc(c1)c1cccc(c1)C
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 4.4
CatalogNumber:
AE66569
ChemicalName:
Methyl 3'-methyl[1,1'-biphenyl]-3-carboxylate
CasNumber:
128460-74-2
MolecularFormula:
C15H14O2
MolecularWeight:
226.27046
MdlNumber:
MFCD05979105
Smiles:
COC(=O)c1cccc(c1)c1cccc(c1)C
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
4.4