CS-1141262
(3aR,9bS)-1,2,3,3a,4,9b-hexahydro-5H-pyrrolo[3,4-c]isoquinolin-5-one hydrochloride
Manufacturer: ChemScene
CAS Number: 873844-60-1
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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
C₁₁H₁₃ClN₂O
Molecular Weight
224.69
Synonyms
None
SMILES
O=C1C=2C([C@@]3([C@@](N1)(CNC3)[H])[H])=CC=CC2.Cl
Tpsa
41.13
Logp
0.9072
H Acceptors
2
H Donors
2
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: C₁₁H₁₃ClN₂O
Molecular Weight: 224.69
Synonyms: None
SMILES: O=C1C=2C([C@@]3([C@@](N1)(CNC3)[H])[H])=CC=CC2.Cl
Tpsa: 41.13
Logp: 0.9072
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₃ClN₂O
Molecular Weight:
224.69
Synonyms:
None
SMILES:
O=C1C=2C([C@@]3([C@@](N1)(CNC3)[H])[H])=CC=CC2.Cl
Tpsa:
41.13
Logp:
0.9072
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂HBrCl₂N₂S
Molecular Weight: 235.91
Synonyms: None
SMILES: Cl.ClC1=NC(Br)=NS1
Tpsa: 25.78
Logp: 2.3758
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂HBrCl₂N₂S
Molecular Weight:
235.91
Synonyms:
None
SMILES:
Cl.ClC1=NC(Br)=NS1
Tpsa:
25.78
Logp:
2.3758
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₂₂ClN
Molecular Weight: 191.74
Synonyms: None
SMILES: Cl.N(C(C)C)C1CCCCCC1
Tpsa: 12.03
Logp: 3.129
H Acceptors: 1
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:
C₁₀H₂₂ClN
Molecular Weight:
191.74
Synonyms:
None
SMILES:
Cl.N(C(C)C)C1CCCCCC1
Tpsa:
12.03
Logp:
3.129
H Acceptors:
1
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: C₁₄H₁₄ClNO₂
Molecular Weight: 263.72
Synonyms: None
SMILES: [Cl-].O=C(O)C1=CC=[N+](C=C1)CC=2C=CC=C(C2)C
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₄ClNO₂
Molecular Weight:
263.72
Synonyms:
None
SMILES:
[Cl-].O=C(O)C1=CC=[N+](C=C1)CC=2C=CC=C(C2)C
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A