AA42929
127682-08-0 | (S)-2-Amino-3-(furan-2-yl)propanoic acid hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA42929
ChemicalName
(S)-2-Amino-3-(furan-2-yl)propanoic acid hydrochloride
CasNumber
127682-08-0
MolecularFormula
C7H10ClNO3
MolecularWeight
191.6122
MdlNumber
MFCD01860886
Smiles
OC(=O)[C@H](Cc1ccco1)N.Cl
Complexity
149
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
-2.3
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CatalogNumber: AA42929
ChemicalName: (S)-2-Amino-3-(furan-2-yl)propanoic acid hydrochloride
CasNumber: 127682-08-0
MolecularFormula: C7H10ClNO3
MolecularWeight: 191.6122
MdlNumber: MFCD01860886
Smiles: OC(=O)[C@H](Cc1ccco1)N.Cl
Complexity: 149
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -2.3
CatalogNumber:
AA42929
ChemicalName:
(S)-2-Amino-3-(furan-2-yl)propanoic acid hydrochloride
CasNumber:
127682-08-0
MolecularFormula:
C7H10ClNO3
MolecularWeight:
191.6122
MdlNumber:
MFCD01860886
Smiles:
OC(=O)[C@H](Cc1ccco1)N.Cl
Complexity:
149
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-2.3
CatalogNumber: AA42930
ChemicalName: 2-Morpholinoisonicotinonitrile
CasNumber: 127680-91-5
MolecularFormula: C10H11N3O
MolecularWeight: 189.2138
MdlNumber: MFCD09934756
Smiles: N#Cc1ccnc(c1)N1CCOCC1
Complexity: 229
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AA42930
ChemicalName:
2-Morpholinoisonicotinonitrile
CasNumber:
127680-91-5
MolecularFormula:
C10H11N3O
MolecularWeight:
189.2138
MdlNumber:
MFCD09934756
Smiles:
N#Cc1ccnc(c1)N1CCOCC1
Complexity:
229
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: AA42931
ChemicalName: 2-Piperidinoisonicotinonitrile
CasNumber: 127680-89-1
MolecularFormula: C11H13N3
MolecularWeight: 187.241
MdlNumber: MFCD06200992
Smiles: N#Cc1ccnc(c1)N1CCCCC1
Complexity: 224
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AA42931
ChemicalName:
2-Piperidinoisonicotinonitrile
CasNumber:
127680-89-1
MolecularFormula:
C11H13N3
MolecularWeight:
187.241
MdlNumber:
MFCD06200992
Smiles:
N#Cc1ccnc(c1)N1CCCCC1
Complexity:
224
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: AA42932
ChemicalName: 2-Pyrrolidinoisonicotinonitrile
CasNumber: 127680-87-9
MolecularFormula: C10H11N3
MolecularWeight: 173.2144
MdlNumber: MFCD08435908
Smiles: N#Cc1ccnc(c1)N1CCCC1
Complexity: 212
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AA42932
ChemicalName:
2-Pyrrolidinoisonicotinonitrile
CasNumber:
127680-87-9
MolecularFormula:
C10H11N3
MolecularWeight:
173.2144
MdlNumber:
MFCD08435908
Smiles:
N#Cc1ccnc(c1)N1CCCC1
Complexity:
212
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.5