CS-0490841
4-(1-Methoxy-1-oxopropan-2-yl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1255042-09-1
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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
C₁₁H₁₂O₄
Molecular Weight
208.21
Synonyms
Benzeneacetic acid, 4-carboxy-α-methyl-, 1-methyl ester
SMILES
COC(=O)C(C)C1=CC=C(C(O)=O)C=C1
Tpsa
63.6
Logp
1.6613
H Acceptors
3
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1255042-09-1 | | A2B Chem | -- |
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: C₁₁H₁₂O₄
Molecular Weight: 208.21
Synonyms: Benzeneacetic acid, 4-carboxy-α-methyl-, 1-methyl ester
SMILES: COC(=O)C(C)C1=CC=C(C(O)=O)C=C1
Tpsa: 63.6
Logp: 1.6613
H Acceptors: 3
H Donors: 1
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:
C₁₁H₁₂O₄
Molecular Weight:
208.21
Synonyms:
Benzeneacetic acid, 4-carboxy-α-methyl-, 1-methyl ester
SMILES:
COC(=O)C(C)C1=CC=C(C(O)=O)C=C1
Tpsa:
63.6
Logp:
1.6613
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD20639198
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₀O₄
Molecular Weight: 194.18
Synonyms: Ibuprofen Related Compound 2
SMILES: OC(=O)C(C)C1=CC=C(C(O)=O)C=C1
Tpsa: 74.6
Logp: 1.5729
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD20639198
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₀O₄
Molecular Weight:
194.18
Synonyms:
Ibuprofen Related Compound 2
SMILES:
OC(=O)C(C)C1=CC=C(C(O)=O)C=C1
Tpsa:
74.6
Logp:
1.5729
H Acceptors:
2
H Donors:
2
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: C₁₂H₁₅NO₂
Molecular Weight: 205.25
Synonyms: None
SMILES: OC1=CC2=C(C=C1)CC3(CCNCC3)O2
Tpsa: 41.49
Logp: 1.4493
H Acceptors: 3
H Donors: 2
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:
C₁₂H₁₅NO₂
Molecular Weight:
205.25
Synonyms:
None
SMILES:
OC1=CC2=C(C=C1)CC3(CCNCC3)O2
Tpsa:
41.49
Logp:
1.4493
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD28664338
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₉N₃
Molecular Weight: 123.16
Synonyms: None
SMILES: CCC1C=C(N)N=NC=1
Tpsa: 51.8
Logp: 0.6212
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD28664338
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₉N₃
Molecular Weight:
123.16
Synonyms:
None
SMILES:
CCC1C=C(N)N=NC=1
Tpsa:
51.8
Logp:
0.6212
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1