AB19096
209128-50-7 | Boc-1,2-trans-ACHC-OH
Manufacturer: A2B Chem
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CatalogNumber
AB19096
ChemicalName
Boc-1,2-trans-ACHC-OH
CasNumber
209128-50-7
MolecularFormula
C12H21NO4
MolecularWeight
243.2994
MdlNumber
MFCD02094138
Smiles
O=C(OC(C)(C)C)N[C@@H]1CCCC[C@H]1C(=O)O
Complexity
295
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
2.5
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CatalogNumber: AB19096
ChemicalName: Boc-1,2-trans-ACHC-OH
CasNumber: 209128-50-7
MolecularFormula: C12H21NO4
MolecularWeight: 243.2994
MdlNumber: MFCD02094138
Smiles: O=C(OC(C)(C)C)N[C@@H]1CCCC[C@H]1C(=O)O
Complexity: 295
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 2.5
CatalogNumber:
AB19096
ChemicalName:
Boc-1,2-trans-ACHC-OH
CasNumber:
209128-50-7
MolecularFormula:
C12H21NO4
MolecularWeight:
243.2994
MdlNumber:
MFCD02094138
Smiles:
O=C(OC(C)(C)C)N[C@@H]1CCCC[C@H]1C(=O)O
Complexity:
295
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
2.5
CatalogNumber: AB19097
ChemicalName: 1'-(tert-Butoxycarbonyl)spiro[indene-1,4'-piperidine]-3-carboxylic acid
CasNumber: 209128-15-4
MolecularFormula: C19H22NO4
MolecularWeight: 328.3823
MdlNumber: MFCD11519415
Smiles: O=C(N1CCC2(CC1)C=C(c1c2cccc1)C(=O)[O-])OC(C)(C)C
Complexity: 552
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.1
CatalogNumber:
AB19097
ChemicalName:
1'-(tert-Butoxycarbonyl)spiro[indene-1,4'-piperidine]-3-carboxylic acid
CasNumber:
209128-15-4
MolecularFormula:
C19H22NO4
MolecularWeight:
328.3823
MdlNumber:
MFCD11519415
Smiles:
O=C(N1CCC2(CC1)C=C(c1c2cccc1)C(=O)[O-])OC(C)(C)C
Complexity:
552
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C[C@@H](C(=O)O)NC(=O)C(C(=O)O)Cc1ccccc1)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C[C@@H](C(=O)O)NC(=O)C(C(=O)O)Cc1ccccc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC#CCSc1ccccc1OC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC#CCSc1ccccc1OC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__