CS-1085192
(4S,5R)-5-(Benzyloxy)oxepane-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2940856-83-5
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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
C₁₄H₁₈O₄
Molecular Weight
250.29
Synonyms
None
SMILES
O(CC1=CC=CC=C1)[C@H]2[C@@H](C(O)=O)CCOCC2
Tpsa
55.76
Logp
2.083
H Acceptors
3
H Donors
1
Rotatable Bonds
4
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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: C₁₄H₁₈O₄
Molecular Weight: 250.29
Synonyms: None
SMILES: O(CC1=CC=CC=C1)[C@H]2[C@@H](C(O)=O)CCOCC2
Tpsa: 55.76
Logp: 2.083
H Acceptors: 3
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:
C₁₄H₁₈O₄
Molecular Weight:
250.29
Synonyms:
None
SMILES:
O(CC1=CC=CC=C1)[C@H]2[C@@H](C(O)=O)CCOCC2
Tpsa:
55.76
Logp:
2.083
H Acceptors:
3
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: C₁₂H₂₂N₂O₃
Molecular Weight: 242.31
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1[C@]2([C@H](CO)C[C@@]1(CNC2)[H])[H]
Tpsa: 61.8
Logp: 0.5761
H Acceptors: 4
H Donors: 2
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:
C₁₂H₂₂N₂O₃
Molecular Weight:
242.31
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1[C@]2([C@H](CO)C[C@@]1(CNC2)[H])[H]
Tpsa:
61.8
Logp:
0.5761
H Acceptors:
4
H Donors:
2
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: C₁₃H₂₁NO₅
Molecular Weight: 271.31
Synonyms: None
SMILES: C(OC)(=O)[C@H]1[C@@]2(O[C@](C1)(CN(C(OC(C)(C)C)=O)C2)[H])[H]
Tpsa: 65.07
Logp: 1.1838
H Acceptors: 5
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:
C₁₃H₂₁NO₅
Molecular Weight:
271.31
Synonyms:
None
SMILES:
C(OC)(=O)[C@H]1[C@@]2(O[C@](C1)(CN(C(OC(C)(C)C)=O)C2)[H])[H]
Tpsa:
65.07
Logp:
1.1838
H Acceptors:
5
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: C₉H₁₅NO₃
Molecular Weight: 185.22
Synonyms: None
SMILES: C(OCC)(=O)[C@H]1[C@@]2(O[C@](C1)(CNC2)[H])[H]
Tpsa: 47.56
Logp: -0.0736
H Acceptors: 4
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:
C₉H₁₅NO₃
Molecular Weight:
185.22
Synonyms:
None
SMILES:
C(OCC)(=O)[C@H]1[C@@]2(O[C@](C1)(CNC2)[H])[H]
Tpsa:
47.56
Logp:
-0.0736
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2