CS-0653779
((3S,5S)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methanol
Manufacturer: ChemScene
CAS Number: 149882-18-8
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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
C₁₄H₁₅F₂N₃O₂
Molecular Weight
295.28
Synonyms
None
SMILES
OC[C@@H](CO1)C[C@]1(C2=C(C=C(C=C2)F)F)CN3C=NC=N3
Tpsa
60.17
Logp
1.4806
H Acceptors
5
H Donors
1
Rotatable Bonds
4
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₄H₁₅F₂N₃O₂
Molecular Weight: 295.28
Synonyms: None
SMILES: OC[C@@H](CO1)C[C@]1(C2=C(C=C(C=C2)F)F)CN3C=NC=N3
Tpsa: 60.17
Logp: 1.4806
H Acceptors: 5
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:
C₁₄H₁₅F₂N₃O₂
Molecular Weight:
295.28
Synonyms:
None
SMILES:
OC[C@@H](CO1)C[C@]1(C2=C(C=C(C=C2)F)F)CN3C=NC=N3
Tpsa:
60.17
Logp:
1.4806
H Acceptors:
5
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: C₂₃H₃₆O₃
Molecular Weight: 360.53
Synonyms: None
SMILES: O[C@H]1CCC[C@@]2(C)[C@@]1([H])CC[C@@H]2[C@H](COCC3=CC=CC(C(C)(O)C)=C3)C
Tpsa: 49.69
Logp: 4.644
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₃₆O₃
Molecular Weight:
360.53
Synonyms:
None
SMILES:
O[C@H]1CCC[C@@]2(C)[C@@]1([H])CC[C@@H]2[C@H](COCC3=CC=CC(C(C)(O)C)=C3)C
Tpsa:
49.69
Logp:
4.644
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
6
Purity: 95%
MDL No: None
Storage: -20°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₃NO
Molecular Weight: 151.21
Synonyms: 3-Ethoxybenzylamine
SMILES: NCC1=CC(OCC)=CC=C1
Tpsa: 35.25
Logp: 1.544
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₃NO
Molecular Weight:
151.21
Synonyms:
3-Ethoxybenzylamine
SMILES:
NCC1=CC(OCC)=CC=C1
Tpsa:
35.25
Logp:
1.544
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: C₁₁H₁₃NO₂
Molecular Weight: 191.23
Synonyms: None
SMILES: O=C(C1=CC=C(C2CN(C2)C)C=C1)O
Tpsa: 40.54
Logp: 1.4138
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃NO₂
Molecular Weight:
191.23
Synonyms:
None
SMILES:
O=C(C1=CC=C(C2CN(C2)C)C=C1)O
Tpsa:
40.54
Logp:
1.4138
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2