CS-0437284
2-(1-Isopropyl-4-oxo-7-(trifluoromethyl)-1,4-dihydrocinnolin-3-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 2765160-85-6
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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
C₁₄H₁₃F₃N₂O₃
Molecular Weight
314.26
Synonyms
None
SMILES
O=C(O)CC1=NN(C(C)C)C2=C(C=CC(C(F)(F)F)=C2)C1=O
Tpsa
72.19
Logp
2.6233
H Acceptors
4
H Donors
1
Rotatable Bonds
3
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: C₁₄H₁₃F₃N₂O₃
Molecular Weight: 314.26
Synonyms: None
SMILES: O=C(O)CC1=NN(C(C)C)C2=C(C=CC(C(F)(F)F)=C2)C1=O
Tpsa: 72.19
Logp: 2.6233
H Acceptors: 4
H Donors: 1
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:
C₁₄H₁₃F₃N₂O₃
Molecular Weight:
314.26
Synonyms:
None
SMILES:
O=C(O)CC1=NN(C(C)C)C2=C(C=CC(C(F)(F)F)=C2)C1=O
Tpsa:
72.19
Logp:
2.6233
H Acceptors:
4
H Donors:
1
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: C₁₆H₁₇NO₃
Molecular Weight: 271.31
Synonyms: Ethanone,1-[2-amino-4-methoxy-5-(phenylmethoxy)phenyl]-
SMILES: CC(C1=CC(OCC2=CC=CC=C2)=C(OC)C=C1N)=O
Tpsa: 61.55
Logp: 3.059
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₇NO₃
Molecular Weight:
271.31
Synonyms:
Ethanone,1-[2-amino-4-methoxy-5-(phenylmethoxy)phenyl]-
SMILES:
CC(C1=CC(OCC2=CC=CC=C2)=C(OC)C=C1N)=O
Tpsa:
61.55
Logp:
3.059
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₈N₂O₂
Molecular Weight: 256.38
Synonyms: 1-Pyrrolidinecarboxylic acid, 4-(3-aminopropyl)-2,2-dimethyl-, 1,1-dimethylethyl ester
SMILES: O=C(N1C(C)(C)CC(CCCN)C1)OC(C)(C)C
Tpsa: 55.56
Logp: 2.7609
H Acceptors: 3
H Donors: 1
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:
C₁₄H₂₈N₂O₂
Molecular Weight:
256.38
Synonyms:
1-Pyrrolidinecarboxylic acid, 4-(3-aminopropyl)-2,2-dimethyl-, 1,1-dimethylethyl ester
SMILES:
O=C(N1C(C)(C)CC(CCCN)C1)OC(C)(C)C
Tpsa:
55.56
Logp:
2.7609
H Acceptors:
3
H Donors:
1
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: C₁₀H₉BrN₂O₂
Molecular Weight: 269.09
Synonyms: None
SMILES: OCCC1=NN=C2C=C(Br)C=CC2=C1O
Tpsa: 66.24
Logp: 1.6327
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₉BrN₂O₂
Molecular Weight:
269.09
Synonyms:
None
SMILES:
OCCC1=NN=C2C=C(Br)C=CC2=C1O
Tpsa:
66.24
Logp:
1.6327
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2