CS-0523303
(S)-5-isopropyl-2-phenyl-2,5,6,8-tetrahydro-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium
Manufacturer: ChemScene
CAS Number: 785042-62-8
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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
C₁₄H₁₈N₃O+
Molecular Weight
244.31
Synonyms
None
SMILES
CC([C@@H]1[N+]2=CN(C3=CC=CC=C3)N=C2COC1)C
Tpsa
30.93
Logp
1.8871
H Acceptors
3
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 785042-62-8 | (S)-5-isopropyl-2-phenyl-2,5,6,8-tetrahydro-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium | A2B Chem | -- |
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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: C₁₄H₁₈N₃O+
Molecular Weight: 244.31
Synonyms: None
SMILES: CC([C@@H]1[N+]2=CN(C3=CC=CC=C3)N=C2COC1)C
Tpsa: 30.93
Logp: 1.8871
H Acceptors: 3
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:
C₁₄H₁₈N₃O+
Molecular Weight:
244.31
Synonyms:
None
SMILES:
CC([C@@H]1[N+]2=CN(C3=CC=CC=C3)N=C2COC1)C
Tpsa:
30.93
Logp:
1.8871
H Acceptors:
3
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: C₈H₁₅Br
Molecular Weight: 191.11
Synonyms: cis-4-methylcyclohexylmethyl bromide
SMILES: C[C@H]1CC[C@@H](CBr)CC1
Tpsa: 0
Logp: 3.2076
H Acceptors: 0
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:
C₈H₁₅Br
Molecular Weight:
191.11
Synonyms:
cis-4-methylcyclohexylmethyl bromide
SMILES:
C[C@H]1CC[C@@H](CBr)CC1
Tpsa:
0
Logp:
3.2076
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD17215742
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₄O₄
Molecular Weight: 234.25
Synonyms: Methyl 2,2-dimethyl-4-oxochroman-6-carboxylate
SMILES: O=C(C1=CC(C(CC(C)(C)O2)=O)=C2C=C1)OC
Tpsa: 52.6
Logp: 2.217
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD17215742
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₄O₄
Molecular Weight:
234.25
Synonyms:
Methyl 2,2-dimethyl-4-oxochroman-6-carboxylate
SMILES:
O=C(C1=CC(C(CC(C)(C)O2)=O)=C2C=C1)OC
Tpsa:
52.6
Logp:
2.217
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD15146185
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₅BrO₂
Molecular Weight: 177.00
Synonyms: None
SMILES: O=C1OC(CBr)C=C1
Tpsa: 26.3
Logp: 0.8629
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD15146185
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₅BrO₂
Molecular Weight:
177.00
Synonyms:
None
SMILES:
O=C1OC(CBr)C=C1
Tpsa:
26.3
Logp:
0.8629
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1