CS-0582446
2-((Octan-2-yloxy)carbonyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 21395-09-5
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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
C₁₆H₂₂O₄
Molecular Weight
278.34
Synonyms
1-METHYLHEPTYL 2-CARBOXYBENZOATE
SMILES
CCCCCCC(C)OC(=O)C1=CC=CC=C1C(=O)O
Tpsa
63.6
Logp
3.9005
H Acceptors
3
H Donors
1
Rotatable Bonds
8
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 21395-09-5 | (+/-)-Mono-2-octyl phthalate | 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: C₁₆H₂₂O₄
Molecular Weight: 278.34
Synonyms: 1-METHYLHEPTYL 2-CARBOXYBENZOATE
SMILES: CCCCCCC(C)OC(=O)C1=CC=CC=C1C(=O)O
Tpsa: 63.6
Logp: 3.9005
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₂O₄
Molecular Weight:
278.34
Synonyms:
1-METHYLHEPTYL 2-CARBOXYBENZOATE
SMILES:
CCCCCCC(C)OC(=O)C1=CC=CC=C1C(=O)O
Tpsa:
63.6
Logp:
3.9005
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆N₂O₃S
Molecular Weight: 186.19
Synonyms: 3-(Carbamoylamino)thiophene-2-carboxylic Acid
SMILES: O=C(C1=C(NC(N)=O)C=CS1)O
Tpsa: 92.42
Logp: 0.9369
H Acceptors: 3
H Donors: 3
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:
C₆H₆N₂O₃S
Molecular Weight:
186.19
Synonyms:
3-(Carbamoylamino)thiophene-2-carboxylic Acid
SMILES:
O=C(C1=C(NC(N)=O)C=CS1)O
Tpsa:
92.42
Logp:
0.9369
H Acceptors:
3
H Donors:
3
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: C₉H₈INO₄
Molecular Weight: 321.07
Synonyms: Benzoic acid, 3-iodo-4-methyl-5-nitro-, methyl ester
SMILES: CC1=C(C=C(C=C1I)C(=O)OC)[N+](=O)[O-]
Tpsa: 69.44
Logp: 2.29442
H Acceptors: 4
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:
C₉H₈INO₄
Molecular Weight:
321.07
Synonyms:
Benzoic acid, 3-iodo-4-methyl-5-nitro-, methyl ester
SMILES:
CC1=C(C=C(C=C1I)C(=O)OC)[N+](=O)[O-]
Tpsa:
69.44
Logp:
2.29442
H Acceptors:
4
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: C₁₁H₈Cl₂N₂
Molecular Weight: 239.10
Synonyms: None
SMILES: NC1=C(C2=CC=C(Cl)C=C2Cl)C=NC=C1
Tpsa: 38.91
Logp: 3.6376
H Acceptors: 2
H Donors: 1
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:
C₁₁H₈Cl₂N₂
Molecular Weight:
239.10
Synonyms:
None
SMILES:
NC1=C(C2=CC=C(Cl)C=C2Cl)C=NC=C1
Tpsa:
38.91
Logp:
3.6376
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1