AH55543
848444-79-1 | 1-Boc-4-carboxyindole
Manufacturer: A2B Chem
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CatalogNumber
AH55543
ChemicalName
1-Boc-4-carboxyindole
CasNumber
848444-79-1
MolecularFormula
C14H15NO4
MolecularWeight
261.2732
MdlNumber
MFCD09834879
Smiles
OC(=O)c1cccc2c1ccn2C(=O)OC(C)(C)C
Complexity
374
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AH55543
ChemicalName: 1-Boc-4-carboxyindole
CasNumber: 848444-79-1
MolecularFormula: C14H15NO4
MolecularWeight: 261.2732
MdlNumber: MFCD09834879
Smiles: OC(=O)c1cccc2c1ccn2C(=O)OC(C)(C)C
Complexity: 374
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AH55543
ChemicalName:
1-Boc-4-carboxyindole
CasNumber:
848444-79-1
MolecularFormula:
C14H15NO4
MolecularWeight:
261.2732
MdlNumber:
MFCD09834879
Smiles:
OC(=O)c1cccc2c1ccn2C(=O)OC(C)(C)C
Complexity:
374
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: AH55544
ChemicalName: (S)-3-(1-Aminoethyl)phenol hcl
CasNumber: 856563-08-1
MolecularFormula: C8H12ClNO
MolecularWeight: 173.64
MdlNumber: MFCD11044547
Smiles: Oc1cccc(c1)[C@H](N)C.Cl
Complexity: 105
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AH55544
ChemicalName:
(S)-3-(1-Aminoethyl)phenol hcl
CasNumber:
856563-08-1
MolecularFormula:
C8H12ClNO
MolecularWeight:
173.64
MdlNumber:
MFCD11044547
Smiles:
Oc1cccc(c1)[C@H](N)C.Cl
Complexity:
105
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1=C(C=C(C=C1)CC(C2=CC(=C(C(=C2)OC)OC)OC)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC1=C(C=C(C=C1)CC(C2=CC(=C(C(=C2)OC)OC)OC)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC1CCCN(C1)CCNC(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC1CCCN(C1)CCNC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__