CS-0770242
5-(3-Hydroxy-1-Propyn-1-yl)-1,3-isobenzofurandione
Manufacturer: ChemScene
CAS Number: 681136-64-1
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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
C₁₁H₆O₄
Molecular Weight
202.16
Synonyms
None
SMILES
OCC#CC1=CC=C2C(=O)OC(=O)C2=C1
Tpsa
63.6
Logp
0.341
H Acceptors
4
H Donors
1
Rotatable Bonds
0
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: C₁₁H₆O₄
Molecular Weight: 202.16
Synonyms: None
SMILES: OCC#CC1=CC=C2C(=O)OC(=O)C2=C1
Tpsa: 63.6
Logp: 0.341
H Acceptors: 4
H Donors: 1
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:
C₁₁H₆O₄
Molecular Weight:
202.16
Synonyms:
None
SMILES:
OCC#CC1=CC=C2C(=O)OC(=O)C2=C1
Tpsa:
63.6
Logp:
0.341
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 85%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₉ClO₂S
Molecular Weight: 300.76
Synonyms: None
SMILES: ClS(=O)(=O)C1=CC=C2C=CC3=CC=CC4=C3C2=C1C=C4
Tpsa: 34.14
Logp: 4.5115
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
85%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₉ClO₂S
Molecular Weight:
300.76
Synonyms:
None
SMILES:
ClS(=O)(=O)C1=CC=C2C=CC3=CC=CC4=C3C2=C1C=C4
Tpsa:
34.14
Logp:
4.5115
H Acceptors:
2
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: C₅H₇NO₅
Molecular Weight: 161.11
Synonyms: None
SMILES: C[C@H](NC(=O)C(O)=O)C(O)=O
Tpsa: 103.7
Logp: -1.3397
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:
C₅H₇NO₅
Molecular Weight:
161.11
Synonyms:
None
SMILES:
C[C@H](NC(=O)C(O)=O)C(O)=O
Tpsa:
103.7
Logp:
-1.3397
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: C₇H₁₅ClO₂Si
Molecular Weight: 194.73
Synonyms: None
SMILES: CC(=O)OCCC[Si](C)(C)Cl
Tpsa: 26.3
Logp: 2.3835
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₅ClO₂Si
Molecular Weight:
194.73
Synonyms:
None
SMILES:
CC(=O)OCCC[Si](C)(C)Cl
Tpsa:
26.3
Logp:
2.3835
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4