CS-1035421
4-(Cyanomethyl)benzenesulfinic acid, sodium salt
Manufacturer: ChemScene
CAS Number: 1856478-03-9
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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
C₈H₇NNaO₂S
Molecular Weight
204.20
Synonyms
None
SMILES
[Na].N#CCC1=CC=C(C=C1)S(=O)O
Tpsa
61.09
Logp
0.95248
H Acceptors
2
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇NNaO₂S
Molecular Weight: 204.20
Synonyms: None
SMILES: [Na].N#CCC1=CC=C(C=C1)S(=O)O
Tpsa: 61.09
Logp: 0.95248
H Acceptors: 2
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:
C₈H₇NNaO₂S
Molecular Weight:
204.20
Synonyms:
None
SMILES:
[Na].N#CCC1=CC=C(C=C1)S(=O)O
Tpsa:
61.09
Logp:
0.95248
H Acceptors:
2
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: C₉H₁₄O₂
Molecular Weight: 154.21
Synonyms: None
SMILES: O=C(CC(=O)C1CCC1)CC
Tpsa: 34.14
Logp: 1.7248
H Acceptors: 2
H Donors: 0
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:
C₉H₁₄O₂
Molecular Weight:
154.21
Synonyms:
None
SMILES:
O=C(CC(=O)C1CCC1)CC
Tpsa:
34.14
Logp:
1.7248
H Acceptors:
2
H Donors:
0
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: C₉H₁₅NO₂S
Molecular Weight: 201.29
Synonyms: None
SMILES: O=S1(=O)C(C)CN(CC#C)CC1C
Tpsa: 37.38
Logp: 0.127
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₅NO₂S
Molecular Weight:
201.29
Synonyms:
None
SMILES:
O=S1(=O)C(C)CN(CC#C)CC1C
Tpsa:
37.38
Logp:
0.127
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₉N
Molecular Weight: 189.30
Synonyms: None
SMILES: C=1C=CC(=CC1)C2NCC(C)CC2C
Tpsa: 12.03
Logp: 2.9932
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₉N
Molecular Weight:
189.30
Synonyms:
None
SMILES:
C=1C=CC(=CC1)C2NCC(C)CC2C
Tpsa:
12.03
Logp:
2.9932
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1