CS-1089809
Methyl (E)-4-(3-hydroxyprop-1-en-1-yl)isothiazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 397329-63-4
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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
C₈H₉NO₃S
Molecular Weight
199.23
Synonyms
None
SMILES
C(OC)(=O)C=1C(/C=C/CO)=CSN1
Tpsa
59.42
Logp
0.9352
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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: C₈H₉NO₃S
Molecular Weight: 199.23
Synonyms: None
SMILES: C(OC)(=O)C=1C(/C=C/CO)=CSN1
Tpsa: 59.42
Logp: 0.9352
H Acceptors: 5
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:
C₈H₉NO₃S
Molecular Weight:
199.23
Synonyms:
None
SMILES:
C(OC)(=O)C=1C(/C=C/CO)=CSN1
Tpsa:
59.42
Logp:
0.9352
H Acceptors:
5
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: C₈H₉NO₂S
Molecular Weight: 183.23
Synonyms: None
SMILES: O=C(OC)C1=NSC=C1CC=C
Tpsa: 39.19
Logp: 1.6582
H Acceptors: 4
H Donors: 0
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:
C₈H₉NO₂S
Molecular Weight:
183.23
Synonyms:
None
SMILES:
O=C(OC)C1=NSC=C1CC=C
Tpsa:
39.19
Logp:
1.6582
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇N₃
Molecular Weight: 145.16
Synonyms: None
SMILES: N=1C=CN=C2C=C(C=NC12)C
Tpsa: 38.67
Logp: 1.33322
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇N₃
Molecular Weight:
145.16
Synonyms:
None
SMILES:
N=1C=CN=C2C=C(C=NC12)C
Tpsa:
38.67
Logp:
1.33322
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₁N₃
Molecular Weight: 245.28
Synonyms: None
SMILES: N=1C=CC=CC1C2=CC=3C=CC=4C=CC=NC4C3N2
Tpsa: 41.57
Logp: 3.7781
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₁N₃
Molecular Weight:
245.28
Synonyms:
None
SMILES:
N=1C=CC=CC1C2=CC=3C=CC=4C=CC=NC4C3N2
Tpsa:
41.57
Logp:
3.7781
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1