CS-0534504
rel-((2S,4S)-4-Amino-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methylpropan-1-ol hydrochloride
Manufacturer: ChemScene
CAS Number: 1345011-38-2
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₂₀ClN₃O₃
Molecular Weight
301.77
Synonyms
None
SMILES
N[C@@H]1C2=CC([N+]([O-])=O)=CC=C2N[C@@H](C1)C(C)(C)CO.Cl
Tpsa
101.42
Logp
2.2191
H Acceptors
5
H Donors
3
Rotatable Bonds
3
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₀ClN₃O₃
Molecular Weight: 301.77
Synonyms: None
SMILES: N[C@@H]1C2=CC([N+]([O-])=O)=CC=C2N[C@@H](C1)C(C)(C)CO.Cl
Tpsa: 101.42
Logp: 2.2191
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₀ClN₃O₃
Molecular Weight:
301.77
Synonyms:
None
SMILES:
N[C@@H]1C2=CC([N+]([O-])=O)=CC=C2N[C@@H](C1)C(C)(C)CO.Cl
Tpsa:
101.42
Logp:
2.2191
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆N₄
Molecular Weight: 158.16
Synonyms: 5-Amino-6-cyano-7-azaindole
SMILES: N#CC1=NC2=C(C=C1N)C=CN2
Tpsa: 78.49
Logp: 1.01678
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆N₄
Molecular Weight:
158.16
Synonyms:
5-Amino-6-cyano-7-azaindole
SMILES:
N#CC1=NC2=C(C=C1N)C=CN2
Tpsa:
78.49
Logp:
1.01678
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₈N₂O₈
Molecular Weight: 342.30
Synonyms: 2-Propenoic acid, 3-[1,2,3,4-tetrahydro-2,4-dioxo-1-β-D-ribofuranosyl-5-pyrimidinyl]-, ethyl ester, (E)- (9CI)
SMILES: O[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1N2C(NC(C(/C=C/C(OCC)=O)=C2)=O)=O
Tpsa: 151.08
Logp: -2.2756
H Acceptors: 9
H Donors: 4
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₈N₂O₈
Molecular Weight:
342.30
Synonyms:
2-Propenoic acid, 3-[1,2,3,4-tetrahydro-2,4-dioxo-1-β-D-ribofuranosyl-5-pyrimidinyl]-, ethyl ester, (E)- (9CI)
SMILES:
O[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1N2C(NC(C(/C=C/C(OCC)=O)=C2)=O)=O
Tpsa:
151.08
Logp:
-2.2756
H Acceptors:
9
H Donors:
4
Rotatable Bonds:
5
Purity: 98%
MDL No: MFCD18209568
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂N₂O₂
Molecular Weight: 180.20
Synonyms: METHYL 6-((1R)-1-AMINOETHYL)PYRIDINE-3-CARBOXYLATE
SMILES: COC(C1=CN=C([C@H](N)C)C=C1)=O
Tpsa: 65.21
Logp: 0.8879
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD18209568
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂N₂O₂
Molecular Weight:
180.20
Synonyms:
METHYL 6-((1R)-1-AMINOETHYL)PYRIDINE-3-CARBOXYLATE
SMILES:
COC(C1=CN=C([C@H](N)C)C=C1)=O
Tpsa:
65.21
Logp:
0.8879
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2