AB50916
61477-39-2 | (S)-3-Aminobutan-1-ol
Manufacturer: A2B Chem
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CatalogNumber
AB50916
ChemicalName
(S)-3-Aminobutan-1-ol
CasNumber
61477-39-2
MolecularFormula
C4H11NO
MolecularWeight
89.1362
MdlNumber
MFCD08275763
Smiles
C[C@@H](CCO)N
Complexity
30.7
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
6
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
-0.6
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CatalogNumber: AB50916
ChemicalName: (S)-3-Aminobutan-1-ol
CasNumber: 61477-39-2
MolecularFormula: C4H11NO
MolecularWeight: 89.1362
MdlNumber: MFCD08275763
Smiles: C[C@@H](CCO)N
Complexity: 30.7
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.6
CatalogNumber:
AB50916
ChemicalName:
(S)-3-Aminobutan-1-ol
CasNumber:
61477-39-2
MolecularFormula:
C4H11NO
MolecularWeight:
89.1362
MdlNumber:
MFCD08275763
Smiles:
C[C@@H](CCO)N
Complexity:
30.7
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50918
ChemicalName: Diethyl hydrogen phosphate
CasNumber: 598-02-7
MolecularFormula: C4H11O4P
MolecularWeight: 154.1015
MdlNumber: MFCD00039889
Smiles: CCOP(=O)(OCC)O
Complexity: 103
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: -0.3
CatalogNumber:
AB50918
ChemicalName:
Diethyl hydrogen phosphate
CasNumber:
598-02-7
MolecularFormula:
C4H11O4P
MolecularWeight:
154.1015
MdlNumber:
MFCD00039889
Smiles:
CCOP(=O)(OCC)O
Complexity:
103
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
-0.3
CatalogNumber: AB50919
ChemicalName: Methyl 3-bromoisonicotinate
CasNumber: 59786-31-1
MolecularFormula: C7H6BrNO2
MolecularWeight: 216.032
MdlNumber: MFCD03788226
Smiles: COC(=O)c1ccncc1Br
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB50919
ChemicalName:
Methyl 3-bromoisonicotinate
CasNumber:
59786-31-1
MolecularFormula:
C7H6BrNO2
MolecularWeight:
216.032
MdlNumber:
MFCD03788226
Smiles:
COC(=O)c1ccncc1Br
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__