CS-0554079
2-(2-Methoxyethyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1212306-34-7
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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
C₁₂H₁₅NO₅
Molecular Weight
253.25
Synonyms
3-(2-METHOXY-ETHYL)-4-OXO-10-OXA-3-AZA-TRICYCLO[5.2.1.0(1,5)]DEC-8-ENE-6-CARBOXYLIC ACID
SMILES
O=C(C(C1C=C2)C(C2(O1)CN3CCOC)C3=O)O
Tpsa
76.07
Logp
-0.5006
H Acceptors
4
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1212306-34-7 | 3-(2-Methoxy-ethyl)-4-oxo-10-oxa-3-aza-tricyclo[5.2.1.0*1,5*]dec-8-ene-6-carboxylic acid | A2B Chem | -- |
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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: C₁₂H₁₅NO₅
Molecular Weight: 253.25
Synonyms: 3-(2-METHOXY-ETHYL)-4-OXO-10-OXA-3-AZA-TRICYCLO[5.2.1.0(1,5)]DEC-8-ENE-6-CARBOXYLIC ACID
SMILES: O=C(C(C1C=C2)C(C2(O1)CN3CCOC)C3=O)O
Tpsa: 76.07
Logp: -0.5006
H Acceptors: 4
H Donors: 1
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:
C₁₂H₁₅NO₅
Molecular Weight:
253.25
Synonyms:
3-(2-METHOXY-ETHYL)-4-OXO-10-OXA-3-AZA-TRICYCLO[5.2.1.0(1,5)]DEC-8-ENE-6-CARBOXYLIC ACID
SMILES:
O=C(C(C1C=C2)C(C2(O1)CN3CCOC)C3=O)O
Tpsa:
76.07
Logp:
-0.5006
H Acceptors:
4
H Donors:
1
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: C₁₆H₁₉NO₄
Molecular Weight: 289.33
Synonyms: rac-2-[(3-Acetylphenyl)carbamoyl]cyclohexanecarboxylic acid
SMILES: CC(=O)C1=CC(=CC=C1)NC(=O)[C@H]2CCCC[C@H]2C(=O)O
Tpsa: 83.47
Logp: 2.7187
H Acceptors: 3
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:
C₁₆H₁₉NO₄
Molecular Weight:
289.33
Synonyms:
rac-2-[(3-Acetylphenyl)carbamoyl]cyclohexanecarboxylic acid
SMILES:
CC(=O)C1=CC(=CC=C1)NC(=O)[C@H]2CCCC[C@H]2C(=O)O
Tpsa:
83.47
Logp:
2.7187
H Acceptors:
3
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: C₁₁H₁₁N₅O₂
Molecular Weight: 245.24
Synonyms: 1-phenyl-3-[2-(1H-1,2,4-triazol-1-yl)acetyl]urea
SMILES: O=C(NC(CN1N=CN=C1)=O)NC2=CC=CC=C2
Tpsa: 88.91
Logp: 0.6264
H Acceptors: 5
H Donors: 2
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:
C₁₁H₁₁N₅O₂
Molecular Weight:
245.24
Synonyms:
1-phenyl-3-[2-(1H-1,2,4-triazol-1-yl)acetyl]urea
SMILES:
O=C(NC(CN1N=CN=C1)=O)NC2=CC=CC=C2
Tpsa:
88.91
Logp:
0.6264
H Acceptors:
5
H Donors:
2
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: C₁₆H₂₅N₃O₂
Molecular Weight: 291.39
Synonyms: 2-tert-Butyl-7,8-dihydro-5H-pyrido[4,3-d]pyriMidine-6-carboxylic acid tert-butyl este
SMILES: CC(C)(C)C1=NC=C2CN(CCC2=N1)C(=O)OC(C)(C)C
Tpsa: 55.32
Logp: 3.0673
H Acceptors: 4
H Donors: 0
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:
C₁₆H₂₅N₃O₂
Molecular Weight:
291.39
Synonyms:
2-tert-Butyl-7,8-dihydro-5H-pyrido[4,3-d]pyriMidine-6-carboxylic acid tert-butyl este
SMILES:
CC(C)(C)C1=NC=C2CN(CCC2=N1)C(=O)OC(C)(C)C
Tpsa:
55.32
Logp:
3.0673
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
0