CS-0442237
5-(Difluoromethyl)isoquinoline
Manufacturer: ChemScene
CAS Number: 1204298-57-6
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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
C₁₀H₇F₂N
Molecular Weight
179.17
Synonyms
None
SMILES
C1=CC2=CN=CC=C2C(=C1)C(F)F
Tpsa
12.89
Logp
3.1724
H Acceptors
1
H Donors
0
Rotatable Bonds
1
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: C₁₀H₇F₂N
Molecular Weight: 179.17
Synonyms: None
SMILES: C1=CC2=CN=CC=C2C(=C1)C(F)F
Tpsa: 12.89
Logp: 3.1724
H Acceptors: 1
H Donors: 0
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:
C₁₀H₇F₂N
Molecular Weight:
179.17
Synonyms:
None
SMILES:
C1=CC2=CN=CC=C2C(=C1)C(F)F
Tpsa:
12.89
Logp:
3.1724
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD11867873
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃BF₆N₂O₂
Molecular Weight: 330.03
Synonyms: 3,5-Bis(trifluoromethyl)-1H-pyrazole-4-boronic acid pinacol ester
SMILES: CC1(C)C(C)(C)OB(C2=C(C(F)(F)F)NN=C2C(F)(F)F)O1
Tpsa: 47.14
Logp: 2.7465
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD11867873
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃BF₆N₂O₂
Molecular Weight:
330.03
Synonyms:
3,5-Bis(trifluoromethyl)-1H-pyrazole-4-boronic acid pinacol ester
SMILES:
CC1(C)C(C)(C)OB(C2=C(C(F)(F)F)NN=C2C(F)(F)F)O1
Tpsa:
47.14
Logp:
2.7465
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: C₃H₄N₄O₂
Molecular Weight: 128.09
Synonyms: 1-Methyl-5-nitro-1,2,3-triazole
SMILES: CN1C(=CN=N1)[N+](=O)[O-]
Tpsa: 73.85
Logp: -0.2767
H Acceptors: 5
H Donors: 0
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:
C₃H₄N₄O₂
Molecular Weight:
128.09
Synonyms:
1-Methyl-5-nitro-1,2,3-triazole
SMILES:
CN1C(=CN=N1)[N+](=O)[O-]
Tpsa:
73.85
Logp:
-0.2767
H Acceptors:
5
H Donors:
0
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: C₈H₆N₄O₂
Molecular Weight: 190.16
Synonyms: 1--1,2,3-triazol
SMILES: C1=C(C=CC(=C1)[N+](=O)[O-])N2C=CN=N2
Tpsa: 73.85
Logp: 1.1755
H Acceptors: 5
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:
C₈H₆N₄O₂
Molecular Weight:
190.16
Synonyms:
1--1,2,3-triazol
SMILES:
C1=C(C=CC(=C1)[N+](=O)[O-])N2C=CN=N2
Tpsa:
73.85
Logp:
1.1755
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2