CS-1022531
Methyl 5-(2-(aminomethyl)phenyl)-1H-pyrazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 1609156-04-8
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₃N₃O₂
Molecular Weight
231.25
Synonyms
None
SMILES
O=C(OC)C1=NNC(=C1)C=2C=CC=CC2CN
Tpsa
81
Logp
1.322
H Acceptors
4
H Donors
2
Rotatable Bonds
3
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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
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Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃N₃O₂
Molecular Weight: 231.25
Synonyms: None
SMILES: O=C(OC)C1=NNC(=C1)C=2C=CC=CC2CN
Tpsa: 81
Logp: 1.322
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃N₃O₂
Molecular Weight:
231.25
Synonyms:
None
SMILES:
O=C(OC)C1=NNC(=C1)C=2C=CC=CC2CN
Tpsa:
81
Logp:
1.322
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁BrF₃NO₂
Molecular Weight: 338.12
Synonyms: None
SMILES: O=C(C1=CC=C(Br)C=C1C(F)(F)F)N2CCOCC2
Tpsa: 29.54
Logp: 2.9403
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₁BrF₃NO₂
Molecular Weight:
338.12
Synonyms:
None
SMILES:
O=C(C1=CC=C(Br)C=C1C(F)(F)F)N2CCOCC2
Tpsa:
29.54
Logp:
2.9403
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₄N₂OS
Molecular Weight: 210.30
Synonyms: None
SMILES: N=1C=NC(=CC1SC2CCOC2C)C
Tpsa: 35.01
Logp: 2.05452
H Acceptors: 4
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:
C₁₀H₁₄N₂OS
Molecular Weight:
210.30
Synonyms:
None
SMILES:
N=1C=NC(=CC1SC2CCOC2C)C
Tpsa:
35.01
Logp:
2.05452
H Acceptors:
4
H Donors:
0
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: C₁₂H₁₃ClN₂O₂
Molecular Weight: 252.70
Synonyms: None
SMILES: Cl.O=CC1=CC=C(OCCN2C=NC=C2)C=C1
Tpsa: 44.12
Logp: 2.1964
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃ClN₂O₂
Molecular Weight:
252.70
Synonyms:
None
SMILES:
Cl.O=CC1=CC=C(OCCN2C=NC=C2)C=C1
Tpsa:
44.12
Logp:
2.1964
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5