CS-1070113
4-Amino-2-fluoro-3,5-dimethylbenzonitrile
Manufacturer: ChemScene
CAS Number: 2722646-13-9
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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
C₉H₉FN₂
Molecular Weight
164.18
Synonyms
None
SMILES
N#CC=1C=C(C(N)=C(C1F)C)C
Tpsa
49.81
Logp
1.89642
H Acceptors
2
H Donors
1
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: C₉H₉FN₂
Molecular Weight: 164.18
Synonyms: None
SMILES: N#CC=1C=C(C(N)=C(C1F)C)C
Tpsa: 49.81
Logp: 1.89642
H Acceptors: 2
H Donors: 1
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:
C₉H₉FN₂
Molecular Weight:
164.18
Synonyms:
None
SMILES:
N#CC=1C=C(C(N)=C(C1F)C)C
Tpsa:
49.81
Logp:
1.89642
H Acceptors:
2
H Donors:
1
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: C₁₂H₁₁NO₂
Molecular Weight: 201.22
Synonyms: None
SMILES: O=C(C1=C(O)C=CC2=NC=CC=C21)CC
Tpsa: 50.19
Logp: 2.5331
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:
C₁₂H₁₁NO₂
Molecular Weight:
201.22
Synonyms:
None
SMILES:
O=C(C1=C(O)C=CC2=NC=CC=C21)CC
Tpsa:
50.19
Logp:
2.5331
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈FNS
Molecular Weight: 157.21
Synonyms: None
SMILES: FC1=NC2=C(S1)CCCC2
Tpsa: 12.89
Logp: 2.161
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈FNS
Molecular Weight:
157.21
Synonyms:
None
SMILES:
FC1=NC2=C(S1)CCCC2
Tpsa:
12.89
Logp:
2.161
H Acceptors:
2
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: C₁₈H₂₃BO₃
Molecular Weight: 298.18
Synonyms: None
SMILES: C[C@]12[C@@]3(C(C)(C)[C@@](C3)(C[C@]1(OB(O2)C4=CC=C(C(C)=O)C=C4)[H])[H])[H]
Tpsa: 35.53
Logp: 2.8245
H Acceptors: 3
H Donors: 0
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:
C₁₈H₂₃BO₃
Molecular Weight:
298.18
Synonyms:
None
SMILES:
C[C@]12[C@@]3(C(C)(C)[C@@](C3)(C[C@]1(OB(O2)C4=CC=C(C(C)=O)C=C4)[H])[H])[H]
Tpsa:
35.53
Logp:
2.8245
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2