CS-1019914
7-Methyl-1-oxoisochromane-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 1593043-25-4
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₉NO₂
Molecular Weight
187.19
Synonyms
None
SMILES
N#CC1OC(=O)C2=CC(=CC=C2C1)C
Tpsa
50.09
Logp
1.6001
H Acceptors
3
H Donors
0
Rotatable Bonds
0
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₉NO₂
Molecular Weight: 187.19
Synonyms: None
SMILES: N#CC1OC(=O)C2=CC(=CC=C2C1)C
Tpsa: 50.09
Logp: 1.6001
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₉NO₂
Molecular Weight:
187.19
Synonyms:
None
SMILES:
N#CC1OC(=O)C2=CC(=CC=C2C1)C
Tpsa:
50.09
Logp:
1.6001
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₄O₃
Molecular Weight: 194.23
Synonyms: None
SMILES: O=C(O)C(OCC1=CC=C(C=C1)C)C
Tpsa: 46.53
Logp: 1.98472
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄O₃
Molecular Weight:
194.23
Synonyms:
None
SMILES:
O=C(O)C(OCC1=CC=C(C=C1)C)C
Tpsa:
46.53
Logp:
1.98472
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁NOS
Molecular Weight: 157.23
Synonyms: None
SMILES: O=C(C=C)C1NCCSC1
Tpsa: 29.1
Logp: 0.4465
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₁NOS
Molecular Weight:
157.23
Synonyms:
None
SMILES:
O=C(C=C)C1NCCSC1
Tpsa:
29.1
Logp:
0.4465
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₅NOS
Molecular Weight: 161.27
Synonyms: None
SMILES: O(CCSCC)C1CNC1
Tpsa: 21.26
Logp: 0.7279
H Acceptors: 3
H Donors: 1
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:
C₇H₁₅NOS
Molecular Weight:
161.27
Synonyms:
None
SMILES:
O(CCSCC)C1CNC1
Tpsa:
21.26
Logp:
0.7279
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5