CS-1070636
Isopropyl 7-chloroisoquinoline-3-carboxylate
Manufacturer: ChemScene
CAS Number: 2733329-72-9
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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
C₁₃H₁₂ClNO₂
Molecular Weight
249.69
Synonyms
None
SMILES
O=C(OC(C)C)C=1N=CC2=CC(Cl)=CC=C2C1
Tpsa
39.19
Logp
3.4534
H Acceptors
3
H Donors
0
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: C₁₃H₁₂ClNO₂
Molecular Weight: 249.69
Synonyms: None
SMILES: O=C(OC(C)C)C=1N=CC2=CC(Cl)=CC=C2C1
Tpsa: 39.19
Logp: 3.4534
H Acceptors: 3
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:
C₁₃H₁₂ClNO₂
Molecular Weight:
249.69
Synonyms:
None
SMILES:
O=C(OC(C)C)C=1N=CC2=CC(Cl)=CC=C2C1
Tpsa:
39.19
Logp:
3.4534
H Acceptors:
3
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: C₁₀H₉BrN₂O
Molecular Weight: 253.10
Synonyms: None
SMILES: BrC=1N=C2C=CC=C(OCC)C2=NC1
Tpsa: 35.01
Logp: 2.791
H Acceptors: 3
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:
C₁₀H₉BrN₂O
Molecular Weight:
253.10
Synonyms:
None
SMILES:
BrC=1N=C2C=CC=C(OCC)C2=NC1
Tpsa:
35.01
Logp:
2.791
H Acceptors:
3
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: C₅H₈N₄O
Molecular Weight: 140.14
Synonyms: None
SMILES: N=1C=C(N)C(=NC1N)OC
Tpsa: 87.05
Logp: -0.3504
H Acceptors: 5
H Donors: 2
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:
C₅H₈N₄O
Molecular Weight:
140.14
Synonyms:
None
SMILES:
N=1C=C(N)C(=NC1N)OC
Tpsa:
87.05
Logp:
-0.3504
H Acceptors:
5
H Donors:
2
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: C₁₂H₁₄BrNO₂
Molecular Weight: 284.15
Synonyms: None
SMILES: O=C(OCC=1C=CC=CC1)N2CC(Br)(C)C2
Tpsa: 29.54
Logp: 2.7924
H Acceptors: 2
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:
C₁₂H₁₄BrNO₂
Molecular Weight:
284.15
Synonyms:
None
SMILES:
O=C(OCC=1C=CC=CC1)N2CC(Br)(C)C2
Tpsa:
29.54
Logp:
2.7924
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2