CS-1159725
4-Amino-4-(3-methylisoxazol-5-yl)but-3-en-2-one
Manufacturer: ChemScene
CAS Number: 65735-19-5
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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
C₈H₁₀N₂O₂
Molecular Weight
166.18
Synonyms
None
SMILES
O=C(C=C(N)C=1ON=C(C1)C)C
Tpsa
69.12
Logp
0.87162
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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: C₈H₁₀N₂O₂
Molecular Weight: 166.18
Synonyms: None
SMILES: O=C(C=C(N)C=1ON=C(C1)C)C
Tpsa: 69.12
Logp: 0.87162
H Acceptors: 4
H Donors: 1
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:
C₈H₁₀N₂O₂
Molecular Weight:
166.18
Synonyms:
None
SMILES:
O=C(C=C(N)C=1ON=C(C1)C)C
Tpsa:
69.12
Logp:
0.87162
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈BrNO₂
Molecular Weight: 254.08
Synonyms: None
SMILES: O=C1C=C(ON1C2=CC=C(Br)C=C2)C
Tpsa: 35.14
Logp: 2.50142
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₈BrNO₂
Molecular Weight:
254.08
Synonyms:
None
SMILES:
O=C1C=C(ON1C2=CC=C(Br)C=C2)C
Tpsa:
35.14
Logp:
2.50142
H Acceptors:
3
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: C₈H₁₃NO₃
Molecular Weight: 171.20
Synonyms: None
SMILES: OCCNCC=1OC(OC)=CC1
Tpsa: 54.63
Logp: 0.3701
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₃NO₃
Molecular Weight:
171.20
Synonyms:
None
SMILES:
OCCNCC=1OC(OC)=CC1
Tpsa:
54.63
Logp:
0.3701
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₂₁NO₂
Molecular Weight: 199.29
Synonyms: None
SMILES: O=C1N(CCCCC1)CCC(O)(C)C
Tpsa: 40.54
Logp: 1.55
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₂₁NO₂
Molecular Weight:
199.29
Synonyms:
None
SMILES:
O=C1N(CCCCC1)CCC(O)(C)C
Tpsa:
40.54
Logp:
1.55
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3