CS-1002254
Benzoic acid, 2-(acetyloxy)-, anhydride with acetic acid
Manufacturer: ChemScene
CAS Number: 18698-59-4
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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
C₁₁H₁₀O₅
Molecular Weight
222.19
Synonyms
None
SMILES
O=C(OC(=O)C)C=1C=CC=CC1OC(=O)C
Tpsa
69.67
Logp
1.3152
H Acceptors
5
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 18698-59-4 | | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₁H₁₀O₅
Molecular Weight: 222.19
Synonyms: None
SMILES: O=C(OC(=O)C)C=1C=CC=CC1OC(=O)C
Tpsa: 69.67
Logp: 1.3152
H Acceptors: 5
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:
C₁₁H₁₀O₅
Molecular Weight:
222.19
Synonyms:
None
SMILES:
O=C(OC(=O)C)C=1C=CC=CC1OC(=O)C
Tpsa:
69.67
Logp:
1.3152
H Acceptors:
5
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: C₂₄H₂₈N₄O₆S₂
Molecular Weight: 532.63
Synonyms: None
SMILES: O=C(O)C1N2C(=O)C(NC(=O)C3N4C(=O)C(NC(=O)CC=5C=CC=CC5)C4SC3(C)C)C2SC1(C)C
Tpsa: 136.12
Logp: 0.4079
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₈N₄O₆S₂
Molecular Weight:
532.63
Synonyms:
None
SMILES:
O=C(O)C1N2C(=O)C(NC(=O)C3N4C(=O)C(NC(=O)CC=5C=CC=CC5)C4SC3(C)C)C2SC1(C)C
Tpsa:
136.12
Logp:
0.4079
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
6
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₄N₂O₄
Molecular Weight: 298.29
Synonyms: None
SMILES: C(=C(\C(OCCC#N)=O)/C(C)=O)\C1=C(OC)C=C(C#N)C=C1
Tpsa: 100.18
Logp: 1.99616
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄N₂O₄
Molecular Weight:
298.29
Synonyms:
None
SMILES:
C(=C(\C(OCCC#N)=O)/C(C)=O)\C1=C(OC)C=C(C#N)C=C1
Tpsa:
100.18
Logp:
1.99616
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₈Cl₂FN₅O
Molecular Weight: 434.29
Synonyms: None
SMILES: N(C=1C2=C(C=C(Cl)C(NC(/C=C/CN(C)C)=O)=C2)N=CN1)C3=CC(Cl)=C(F)C=C3
Tpsa: 70.15
Logp: 4.8756
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₈Cl₂FN₅O
Molecular Weight:
434.29
Synonyms:
None
SMILES:
N(C=1C2=C(C=C(Cl)C(NC(/C=C/CN(C)C)=O)=C2)N=CN1)C3=CC(Cl)=C(F)C=C3
Tpsa:
70.15
Logp:
4.8756
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
6