CS-0628135
rel-(3aR,6aR)-2-Benzyl-3a-fluorooctahydropyrrolo[3,4-c]pyrrole
Manufacturer: ChemScene
CAS Number: 1776114-20-5
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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
C₁₃H₁₇FN₂
Molecular Weight
220.29
Synonyms
None
SMILES
F[C@@]12[C@@](CNC2)([H])CN(CC3=CC=CC=C3)C1
Tpsa
15.27
Logp
1.4299
H Acceptors
2
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: C₁₃H₁₇FN₂
Molecular Weight: 220.29
Synonyms: None
SMILES: F[C@@]12[C@@](CNC2)([H])CN(CC3=CC=CC=C3)C1
Tpsa: 15.27
Logp: 1.4299
H Acceptors: 2
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:
C₁₃H₁₇FN₂
Molecular Weight:
220.29
Synonyms:
None
SMILES:
F[C@@]12[C@@](CNC2)([H])CN(CC3=CC=CC=C3)C1
Tpsa:
15.27
Logp:
1.4299
H Acceptors:
2
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: C₆H₆F₂N₂O
Molecular Weight: 160.12
Synonyms: None
SMILES: OCC1=NC=C(C(F)F)N=C1
Tpsa: 46.01
Logp: 0.9065
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:
C₆H₆F₂N₂O
Molecular Weight:
160.12
Synonyms:
None
SMILES:
OCC1=NC=C(C(F)F)N=C1
Tpsa:
46.01
Logp:
0.9065
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: C₇H₁₃FN₂
Molecular Weight: 144.19
Synonyms: None
SMILES: CN1C[C@](CNC2)([H])[C@]2(F)C1
Tpsa: 15.27
Logp: -0.1405
H Acceptors: 2
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:
C₇H₁₃FN₂
Molecular Weight:
144.19
Synonyms:
None
SMILES:
CN1C[C@](CNC2)([H])[C@]2(F)C1
Tpsa:
15.27
Logp:
-0.1405
H Acceptors:
2
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: C₁₄H₁₂O₃S
Molecular Weight: 260.31
Synonyms: None
SMILES: CC(SC1=CC(OC(C)=O)=C2C=CC=CC2=C1)=O
Tpsa: 43.37
Logp: 3.4037
H Acceptors: 4
H Donors: 0
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:
C₁₄H₁₂O₃S
Molecular Weight:
260.31
Synonyms:
None
SMILES:
CC(SC1=CC(OC(C)=O)=C2C=CC=CC2=C1)=O
Tpsa:
43.37
Logp:
3.4037
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2