AB45661
327156-95-6 | Boc-cis-1,4-aminocyclohexyl acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB45661
ChemicalName
Boc-cis-1,4-aminocyclohexyl acetic acid
CasNumber
327156-95-6
MolecularFormula
C13H23NO4
MolecularWeight
257.326
MdlNumber
MFCD01862296
Smiles
O=C(OC(C)(C)C)N[C@@H]1CC[C@@H](CC1)CC(=O)O
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
2
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CatalogNumber: AB45661
ChemicalName: Boc-cis-1,4-aminocyclohexyl acetic acid
CasNumber: 327156-95-6
MolecularFormula: C13H23NO4
MolecularWeight: 257.326
MdlNumber: MFCD01862296
Smiles: O=C(OC(C)(C)C)N[C@@H]1CC[C@@H](CC1)CC(=O)O
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 2
CatalogNumber:
AB45661
ChemicalName:
Boc-cis-1,4-aminocyclohexyl acetic acid
CasNumber:
327156-95-6
MolecularFormula:
C13H23NO4
MolecularWeight:
257.326
MdlNumber:
MFCD01862296
Smiles:
O=C(OC(C)(C)C)N[C@@H]1CC[C@@H](CC1)CC(=O)O
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H](Cc1ccc(cc1)Cl)NC(=O)OC(C)(C)C
Complexity: 346
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H](Cc1ccc(cc1)Cl)NC(=O)OC(C)(C)C
Complexity:
346
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1nc[nH]c1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1nc[nH]c1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H](NC(=O)OC(C)(C)C)CCc1ccccc1
Complexity: 329
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H](NC(=O)OC(C)(C)C)CCc1ccccc1
Complexity:
329
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9