CS-0361064
7-(4-Fluorophenyl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 515824-25-6
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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
C₁₁H₈FN₅O₂
Molecular Weight
261.21
Synonyms
None
SMILES
C1=C(C=CC(=C1)F)C2C=C(C(=O)O)N=C3N=NNN23
Tpsa
89.65
Logp
1.3923
H Acceptors
6
H Donors
2
Rotatable Bonds
2
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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: C₁₁H₈FN₅O₂
Molecular Weight: 261.21
Synonyms: None
SMILES: C1=C(C=CC(=C1)F)C2C=C(C(=O)O)N=C3N=NNN23
Tpsa: 89.65
Logp: 1.3923
H Acceptors: 6
H Donors: 2
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:
C₁₁H₈FN₅O₂
Molecular Weight:
261.21
Synonyms:
None
SMILES:
C1=C(C=CC(=C1)F)C2C=C(C(=O)O)N=C3N=NNN23
Tpsa:
89.65
Logp:
1.3923
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
2
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₁₉F₃N₂O₂S
Molecular Weight: 420.45
Synonyms: None
SMILES: C1C2CC3CC1CC(C2)(C3)C4=NC5=C(C(=C4)C(F)(F)F)C6=C(C(=CC(=N6)O)O)S5
Tpsa: 66.24
Logp: 5.7423
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 1
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₁₉F₃N₂O₂S
Molecular Weight:
420.45
Synonyms:
None
SMILES:
C1C2CC3CC1CC(C2)(C3)C4=NC5=C(C(=C4)C(F)(F)F)C6=C(C(=CC(=N6)O)O)S5
Tpsa:
66.24
Logp:
5.7423
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: C₁₂H₁₀O₃
Molecular Weight: 202.21
Synonyms: 7-Allyloxycoumarin
SMILES: C=CCOC1=CC2=C(C=C1)C=CC(=O)O2
Tpsa: 39.44
Logp: 2.3578
H Acceptors: 3
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:
C₁₂H₁₀O₃
Molecular Weight:
202.21
Synonyms:
7-Allyloxycoumarin
SMILES:
C=CCOC1=CC2=C(C=C1)C=CC(=O)O2
Tpsa:
39.44
Logp:
2.3578
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₀O₅
Molecular Weight: 246.22
Synonyms: None
SMILES: C=CCOC1=CC2=C(C=C1)C(=CC(=O)O2)C(=O)O
Tpsa: 76.74
Logp: 2.056
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₀O₅
Molecular Weight:
246.22
Synonyms:
None
SMILES:
C=CCOC1=CC2=C(C=C1)C(=CC(=O)O2)C(=O)O
Tpsa:
76.74
Logp:
2.056
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4