CS-0554673
1-(3-(4-Chlorophenyl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 87628-27-1
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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
C₁₄H₁₄ClN₃O
Molecular Weight
275.73
Synonyms
1-[3-(4-chloro-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
SMILES
CC(=O)N1CCC2=C(C1)C(=NN2)C3=CC=C(C=C3)Cl
Tpsa
48.99
Logp
2.6347
H Acceptors
2
H Donors
1
Rotatable Bonds
1
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: C₁₄H₁₄ClN₃O
Molecular Weight: 275.73
Synonyms: 1-[3-(4-chloro-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
SMILES: CC(=O)N1CCC2=C(C1)C(=NN2)C3=CC=C(C=C3)Cl
Tpsa: 48.99
Logp: 2.6347
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₄ClN₃O
Molecular Weight:
275.73
Synonyms:
1-[3-(4-chloro-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
SMILES:
CC(=O)N1CCC2=C(C1)C(=NN2)C3=CC=C(C=C3)Cl
Tpsa:
48.99
Logp:
2.6347
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉N₃O₄
Molecular Weight: 211.17
Synonyms: N-Hydroxy-2-(4-nitrophenoxy)ethanimidamide
SMILES: C1=CC(=CC=C1[N+](=O)[O-])OC/C(=N/O)/N
Tpsa: 110.98
Logp: 0.72
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉N₃O₄
Molecular Weight:
211.17
Synonyms:
N-Hydroxy-2-(4-nitrophenoxy)ethanimidamide
SMILES:
C1=CC(=CC=C1[N+](=O)[O-])OC/C(=N/O)/N
Tpsa:
110.98
Logp:
0.72
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₁NO₃
Molecular Weight: 287.35
Synonyms: (R)-Etodolac
SMILES: CCC1=C2C(=CC=C1)C3=C(N2)[C@@](OCC3)(CC)CC(=O)O
Tpsa: 62.32
Logp: 3.383
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₁NO₃
Molecular Weight:
287.35
Synonyms:
(R)-Etodolac
SMILES:
CCC1=C2C(=CC=C1)C3=C(N2)[C@@](OCC3)(CC)CC(=O)O
Tpsa:
62.32
Logp:
3.383
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₁NO₅
Molecular Weight: 307.34
Synonyms: (4R,5S)-2-Benzyl-isoxazolidine-4,5-dicarboxylic acid diethyl ester RACEMATE
SMILES: CCOC(=O)[C@@H]1CN(O[C@@H]1C(=O)OCC)CC2=CC=CC=C2
Tpsa: 65.07
Logp: 1.5448
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₁NO₅
Molecular Weight:
307.34
Synonyms:
(4R,5S)-2-Benzyl-isoxazolidine-4,5-dicarboxylic acid diethyl ester RACEMATE
SMILES:
CCOC(=O)[C@@H]1CN(O[C@@H]1C(=O)OCC)CC2=CC=CC=C2
Tpsa:
65.07
Logp:
1.5448
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
6