CS-1070464
1-(Isoquinolin-1-yl)butan-2-one
Manufacturer: ChemScene
CAS Number: 27302-23-4
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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
C₁₃H₁₃NO
Molecular Weight
199.25
Synonyms
None
SMILES
O=C(CC1=NC=CC=2C=CC=CC21)CC
Tpsa
29.96
Logp
2.7564
H Acceptors
2
H Donors
0
Rotatable Bonds
3
Related Products
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: C₁₃H₁₃NO
Molecular Weight: 199.25
Synonyms: None
SMILES: O=C(CC1=NC=CC=2C=CC=CC21)CC
Tpsa: 29.96
Logp: 2.7564
H Acceptors: 2
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:
C₁₃H₁₃NO
Molecular Weight:
199.25
Synonyms:
None
SMILES:
O=C(CC1=NC=CC=2C=CC=CC21)CC
Tpsa:
29.96
Logp:
2.7564
H Acceptors:
2
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: C₇H₇ClN₄
Molecular Weight: 182.61
Synonyms: None
SMILES: ClC=1N=C(N)C2=C(N1)NC=C2C
Tpsa: 67.59
Logp: 1.50192
H Acceptors: 3
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:
C₇H₇ClN₄
Molecular Weight:
182.61
Synonyms:
None
SMILES:
ClC=1N=C(N)C2=C(N1)NC=C2C
Tpsa:
67.59
Logp:
1.50192
H Acceptors:
3
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: C₁₁H₉NO₂
Molecular Weight: 187.19
Synonyms: None
SMILES: O=C(C=1N=C2C=CC=C(O)C2=CC1)C
Tpsa: 50.19
Logp: 2.143
H Acceptors: 3
H Donors: 1
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:
C₁₁H₉NO₂
Molecular Weight:
187.19
Synonyms:
None
SMILES:
O=C(C=1N=C2C=CC=C(O)C2=CC1)C
Tpsa:
50.19
Logp:
2.143
H Acceptors:
3
H Donors:
1
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: C₈H₉ClN₂O₂
Molecular Weight: 200.62
Synonyms: None
SMILES: O=C(OC(C)C)C1=NC=CC(Cl)=N1
Tpsa: 52.08
Logp: 1.6952
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:
C₈H₉ClN₂O₂
Molecular Weight:
200.62
Synonyms:
None
SMILES:
O=C(OC(C)C)C1=NC=CC(Cl)=N1
Tpsa:
52.08
Logp:
1.6952
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2