CS-0521198
(1R,5S,6r)-2,4-dioxo-3-oxabicyclo[3.1.0]Hexane-6-carboxylic acid
Manufacturer: ChemScene
CAS Number: 187681-87-4
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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
C₆H₄O₅
Molecular Weight
156.09
Synonyms
3-Oxabicyclo[3.1.0]hexane-6-carboxylicacid,2,4-dioxo-,(1alpha,5alpha,6alpha)-(9CI)
SMILES
[H][C@@]12C(=O)OC(=O)[C@]1([H])[C@@H]2C(=O)O
Tpsa
80.67
Logp
-0.9834
H Acceptors
4
H Donors
1
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 187681-87-4 | 3-Oxabicyclo[3.1.0]hexane-6-carboxylicacid,2,4-dioxo-,(1alpha,5alpha,6alpha)-(9CI) | A2B Chem | -- |
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2923
Class
8 (6.1)
Packing Group
Ⅲ
Hazard Statements
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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: C₆H₄O₅
Molecular Weight: 156.09
Synonyms: 3-Oxabicyclo[3.1.0]hexane-6-carboxylicacid,2,4-dioxo-,(1alpha,5alpha,6alpha)-(9CI)
SMILES: [H][C@@]12C(=O)OC(=O)[C@]1([H])[C@@H]2C(=O)O
Tpsa: 80.67
Logp: -0.9834
H Acceptors: 4
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:
C₆H₄O₅
Molecular Weight:
156.09
Synonyms:
3-Oxabicyclo[3.1.0]hexane-6-carboxylicacid,2,4-dioxo-,(1alpha,5alpha,6alpha)-(9CI)
SMILES:
[H][C@@]12C(=O)OC(=O)[C@]1([H])[C@@H]2C(=O)O
Tpsa:
80.67
Logp:
-0.9834
H Acceptors:
4
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: C₉H₇NO₂
Molecular Weight: 161.16
Synonyms: None
SMILES: C#CC1=CC=C([N+](=O)[O-])C(C)=C1
Tpsa: 43.14
Logp: 1.88452
H Acceptors: 2
H Donors: 0
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:
C₉H₇NO₂
Molecular Weight:
161.16
Synonyms:
None
SMILES:
C#CC1=CC=C([N+](=O)[O-])C(C)=C1
Tpsa:
43.14
Logp:
1.88452
H Acceptors:
2
H Donors:
0
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: C₁₂H₁₃FO₃
Molecular Weight: 224.23
Synonyms: None
SMILES: O=C(OCC)/C=C/C1=CC=C(OC)C(F)=C1
Tpsa: 35.53
Logp: 2.4106
H Acceptors: 3
H Donors: 0
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:
C₁₂H₁₃FO₃
Molecular Weight:
224.23
Synonyms:
None
SMILES:
O=C(OCC)/C=C/C1=CC=C(OC)C(F)=C1
Tpsa:
35.53
Logp:
2.4106
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD07371676
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁NO₂
Molecular Weight: 165.19
Synonyms: Amino(3-methylphenyl)acetic acid
SMILES: CC1=CC([C@@H](N)C(=O)O)=CC=C1
Tpsa: 63.32
Logp: 1.07942
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD07371676
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁NO₂
Molecular Weight:
165.19
Synonyms:
Amino(3-methylphenyl)acetic acid
SMILES:
CC1=CC([C@@H](N)C(=O)O)=CC=C1
Tpsa:
63.32
Logp:
1.07942
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2