CS-0364737
2-(8-Oxo-5,6,7,8-tetrahydro-1H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 842975-51-3
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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
C₁₀H₁₀N₄O₃
Molecular Weight
234.21
Synonyms
(8-Oxo-5,6,7,8-tetrahydro-1H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid
SMILES
C1CC2=C(C1)N=C3N=C(CC(=O)O)NN3C2=O
Tpsa
100.35
Logp
-0.4666
H Acceptors
5
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: C₁₀H₁₀N₄O₃
Molecular Weight: 234.21
Synonyms: (8-Oxo-5,6,7,8-tetrahydro-1H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid
SMILES: C1CC2=C(C1)N=C3N=C(CC(=O)O)NN3C2=O
Tpsa: 100.35
Logp: -0.4666
H Acceptors: 5
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:
C₁₀H₁₀N₄O₃
Molecular Weight:
234.21
Synonyms:
(8-Oxo-5,6,7,8-tetrahydro-1H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid
SMILES:
C1CC2=C(C1)N=C3N=C(CC(=O)O)NN3C2=O
Tpsa:
100.35
Logp:
-0.4666
H Acceptors:
5
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: C₁₆H₁₆Cl₂N₂O₃S
Molecular Weight: 387.28
Synonyms: 2-[2,4-DICHLORO(METHYLSULFONYL)ANILINO]-N-METHYL-N-PHENYLACETAMIDE
SMILES: O=C(N(C)C1=CC=CC=C1)CN(S(=O)(C)=O)C2=CC=C(Cl)C=C2Cl
Tpsa: 57.69
Logp: 3.4224
H Acceptors: 3
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:
C₁₆H₁₆Cl₂N₂O₃S
Molecular Weight:
387.28
Synonyms:
2-[2,4-DICHLORO(METHYLSULFONYL)ANILINO]-N-METHYL-N-PHENYLACETAMIDE
SMILES:
O=C(N(C)C1=CC=CC=C1)CN(S(=O)(C)=O)C2=CC=C(Cl)C=C2Cl
Tpsa:
57.69
Logp:
3.4224
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁NO
Molecular Weight: 137.18
Synonyms: 2-HYDROXY-3-METHYLBENZYLAMINE
SMILES: CC1=C(C(=CC=C1)CN)O
Tpsa: 46.25
Logp: 1.15932
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₁NO
Molecular Weight:
137.18
Synonyms:
2-HYDROXY-3-METHYLBENZYLAMINE
SMILES:
CC1=C(C(=CC=C1)CN)O
Tpsa:
46.25
Logp:
1.15932
H Acceptors:
2
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: C₉H₁₁NO₂
Molecular Weight: 165.19
Synonyms: Phenol, 2-(aminomethyl)-, acetate (ester) (9CI)
SMILES: NCC1=CC=CC=C1OC(C)=O
Tpsa: 52.32
Logp: 1.0706
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:
C₉H₁₁NO₂
Molecular Weight:
165.19
Synonyms:
Phenol, 2-(aminomethyl)-, acetate (ester) (9CI)
SMILES:
NCC1=CC=CC=C1OC(C)=O
Tpsa:
52.32
Logp:
1.0706
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2