CS-1005058
3-Oxo-1-azabicyclo[2.2.2]octane-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 857019-15-9
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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
C₈H₁₁NO₃
Molecular Weight
169.18
Synonyms
None
SMILES
O=C(O)C1C(=O)C2CCN1CC2
Tpsa
57.61
Logp
-0.2657
H Acceptors
3
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: C₈H₁₁NO₃
Molecular Weight: 169.18
Synonyms: None
SMILES: O=C(O)C1C(=O)C2CCN1CC2
Tpsa: 57.61
Logp: -0.2657
H Acceptors: 3
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:
C₈H₁₁NO₃
Molecular Weight:
169.18
Synonyms:
None
SMILES:
O=C(O)C1C(=O)C2CCN1CC2
Tpsa:
57.61
Logp:
-0.2657
H Acceptors:
3
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: C₁₂H₁₄O₃
Molecular Weight: 206.24
Synonyms: None
SMILES: O=C(O)C(C1=CC=C(C=C1)C(=O)C)(C)C
Tpsa: 54.37
Logp: 2.2514
H Acceptors: 2
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:
C₁₂H₁₄O₃
Molecular Weight:
206.24
Synonyms:
None
SMILES:
O=C(O)C(C1=CC=C(C=C1)C(=O)C)(C)C
Tpsa:
54.37
Logp:
2.2514
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₇H₆₅NO₁₂
Molecular Weight: 715.91
Synonyms: None
SMILES: O([C@H]1[C@@]2(C)OC(=C(C)C2)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@H](C)[C@@H](O[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3)[C@@H]1C)[C@H]4[C@H](O)[C@@H](N(C)C)C[C@@H](C)O4
Tpsa: 165.84
Logp: 2.8923
H Acceptors: 13
H Donors: 4
Rotatable Bonds: 7
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₇H₆₅NO₁₂
Molecular Weight:
715.91
Synonyms:
None
SMILES:
O([C@H]1[C@@]2(C)OC(=C(C)C2)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@H](C)[C@@H](O[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3)[C@@H]1C)[C@H]4[C@H](O)[C@@H](N(C)C)C[C@@H](C)O4
Tpsa:
165.84
Logp:
2.8923
H Acceptors:
13
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₈N₂O₄S
Molecular Weight: 334.39
Synonyms: None
SMILES: O=C(O)C1NC(SC1(C)C)C2N=C(OC2=O)CC=3C=CC=CC3
Tpsa: 87.99
Logp: 1.4473
H Acceptors: 6
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:
C₁₆H₁₈N₂O₄S
Molecular Weight:
334.39
Synonyms:
None
SMILES:
O=C(O)C1NC(SC1(C)C)C2N=C(OC2=O)CC=3C=CC=CC3
Tpsa:
87.99
Logp:
1.4473
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4