CS-0799932
[(2R)-2-(6-Chloro-5-iodo-1-oxo-2-isoquinolyl)propyl] acetate
Manufacturer: ChemScene
CAS Number: 1058709-94-6
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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
C₁₄H₁₃ClINO₃
Molecular Weight
405.62
Synonyms
None
SMILES
CC(=O)OC[C@@H](C)N1C(=O)C2C(C=C1)=C(I)C(Cl)=CC=2
Tpsa
48.3
Logp
3.3836
H Acceptors
4
H Donors
0
Rotatable Bonds
3
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: C₁₄H₁₃ClINO₃
Molecular Weight: 405.62
Synonyms: None
SMILES: CC(=O)OC[C@@H](C)N1C(=O)C2C(C=C1)=C(I)C(Cl)=CC=2
Tpsa: 48.3
Logp: 3.3836
H Acceptors: 4
H Donors: 0
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:
C₁₄H₁₃ClINO₃
Molecular Weight:
405.62
Synonyms:
None
SMILES:
CC(=O)OC[C@@H](C)N1C(=O)C2C(C=C1)=C(I)C(Cl)=CC=2
Tpsa:
48.3
Logp:
3.3836
H Acceptors:
4
H Donors:
0
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: C₁₄H₁₆INO₃
Molecular Weight: 373.19
Synonyms: None
SMILES: ICCCOC1=C(OC)C=C2C(=C1)C(=O)N(C)C=C2
Tpsa: 40.46
Logp: 2.751
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₆INO₃
Molecular Weight:
373.19
Synonyms:
None
SMILES:
ICCCOC1=C(OC)C=C2C(=C1)C(=O)N(C)C=C2
Tpsa:
40.46
Logp:
2.751
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₆O₃
Molecular Weight: 160.21
Synonyms: None
SMILES: OC[C@@H](C)C(=O)OC(C)(C)C
Tpsa: 46.53
Logp: 0.9565
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:
C₈H₁₆O₃
Molecular Weight:
160.21
Synonyms:
None
SMILES:
OC[C@@H](C)C(=O)OC(C)(C)C
Tpsa:
46.53
Logp:
0.9565
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: C₁₀H₈BrNO
Molecular Weight: 238.08
Synonyms: None
SMILES: CN1C(=O)C2C(=CC=CC=2)C=C1Br
Tpsa: 22
Logp: 2.301
H Acceptors: 2
H Donors: 0
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:
C₁₀H₈BrNO
Molecular Weight:
238.08
Synonyms:
None
SMILES:
CN1C(=O)C2C(=CC=CC=2)C=C1Br
Tpsa:
22
Logp:
2.301
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0