CS-1085736
(3R,4R)-4-Hydroxyoxepane-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 2940875-65-8
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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
C₇H₁₁NO₂
Molecular Weight
141.17
Synonyms
None
SMILES
C(#N)[C@H]1[C@H](O)CCCOC1
Tpsa
53.25
Logp
0.29748
H Acceptors
3
H Donors
1
Rotatable Bonds
0
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: C₇H₁₁NO₂
Molecular Weight: 141.17
Synonyms: None
SMILES: C(#N)[C@H]1[C@H](O)CCCOC1
Tpsa: 53.25
Logp: 0.29748
H Acceptors: 3
H Donors: 1
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:
C₇H₁₁NO₂
Molecular Weight:
141.17
Synonyms:
None
SMILES:
C(#N)[C@H]1[C@H](O)CCCOC1
Tpsa:
53.25
Logp:
0.29748
H Acceptors:
3
H Donors:
1
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: C₁₄H₂₆N₂O₄
Molecular Weight: 286.37
Synonyms: None
SMILES: C(OC)(=O)[C@@]1(N)[C@@H](CCC)CN(C(OC(C)(C)C)=O)C1
Tpsa: 81.86
Logp: 1.5239
H Acceptors: 5
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:
C₁₄H₂₆N₂O₄
Molecular Weight:
286.37
Synonyms:
None
SMILES:
C(OC)(=O)[C@@]1(N)[C@@H](CCC)CN(C(OC(C)(C)C)=O)C1
Tpsa:
81.86
Logp:
1.5239
H Acceptors:
5
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: C₁₃H₂₀FNO₅
Molecular Weight: 289.30
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1[C@]2([C@@]([C@@H](F)[C@@H]1C(OC)=O)(COC2)[H])[H]
Tpsa: 65.07
Logp: 1.1318
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:
C₁₃H₂₀FNO₅
Molecular Weight:
289.30
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1[C@]2([C@@]([C@@H](F)[C@@H]1C(OC)=O)(COC2)[H])[H]
Tpsa:
65.07
Logp:
1.1318
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: C₁₄H₂₇NO₃
Molecular Weight: 257.37
Synonyms: None
SMILES: [C@H](C)(C)[C@H]1[C@H](CO)CCN(C(OC(C)(C)C)=O)C1
Tpsa: 49.77
Logp: 2.5079
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:
C₁₄H₂₇NO₃
Molecular Weight:
257.37
Synonyms:
None
SMILES:
[C@H](C)(C)[C@H]1[C@H](CO)CCN(C(OC(C)(C)C)=O)C1
Tpsa:
49.77
Logp:
2.5079
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2