CS-0929956
(2S,3R)-3-(Methoxycarbonyl)bicyclo[2.2.2]octane-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1071781-53-7
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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
C₁₁H₁₆O₄
Molecular Weight
212.24
Synonyms
None
SMILES
C(OC)(=O)[C@H]1[C@@H](C(O)=O)C2CCC1CC2
Tpsa
63.6
Logp
1.2964
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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: C₁₁H₁₆O₄
Molecular Weight: 212.24
Synonyms: None
SMILES: C(OC)(=O)[C@H]1[C@@H](C(O)=O)C2CCC1CC2
Tpsa: 63.6
Logp: 1.2964
H Acceptors: 3
H Donors: 1
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:
C₁₁H₁₆O₄
Molecular Weight:
212.24
Synonyms:
None
SMILES:
C(OC)(=O)[C@H]1[C@@H](C(O)=O)C2CCC1CC2
Tpsa:
63.6
Logp:
1.2964
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₅BrO₃
Molecular Weight: 299.16
Synonyms: None
SMILES: O=C(OC(C)(C)C)CC(=O)C=1C=CC=C(Br)C1
Tpsa: 43.37
Logp: 3.3636
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅BrO₃
Molecular Weight:
299.16
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)CC(=O)C=1C=CC=C(Br)C1
Tpsa:
43.37
Logp:
3.3636
H Acceptors:
3
H Donors:
0
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: C₄H₆N₂O₂S₂
Molecular Weight: 178.23
Synonyms: None
SMILES: O=S(=O)(N)C1=CSC(N)=C1
Tpsa: 86.18
Logp: -0.0223
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₆N₂O₂S₂
Molecular Weight:
178.23
Synonyms:
None
SMILES:
O=S(=O)(N)C1=CSC(N)=C1
Tpsa:
86.18
Logp:
-0.0223
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇FO₃
Molecular Weight: 182.15
Synonyms: None
SMILES: O=CC1=CC=C2OCCOC2=C1F
Tpsa: 35.53
Logp: 1.4094
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇FO₃
Molecular Weight:
182.15
Synonyms:
None
SMILES:
O=CC1=CC=C2OCCOC2=C1F
Tpsa:
35.53
Logp:
1.4094
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1