CS-0759038
3-(2-Amino-Ethylsulfanylmethyl)-benzonitrile
Manufacturer: ChemScene
CAS Number: 1016730-28-1
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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
C₁₀H₁₂N₂S
Molecular Weight
192.28
Synonyms
None
SMILES
NCCSCC1=CC=CC(=C1)C#N
Tpsa
49.81
Logp
1.75018
H Acceptors
3
H Donors
1
Rotatable Bonds
4
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂N₂S
Molecular Weight: 192.28
Synonyms: None
SMILES: NCCSCC1=CC=CC(=C1)C#N
Tpsa: 49.81
Logp: 1.75018
H Acceptors: 3
H Donors: 1
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:
C₁₀H₁₂N₂S
Molecular Weight:
192.28
Synonyms:
None
SMILES:
NCCSCC1=CC=CC(=C1)C#N
Tpsa:
49.81
Logp:
1.75018
H Acceptors:
3
H Donors:
1
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: C₁₁H₁₇NO₂S
Molecular Weight: 227.32
Synonyms: None
SMILES: COC1=CC=CC(CSCCN)=C1OC
Tpsa: 44.48
Logp: 1.8957
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₇NO₂S
Molecular Weight:
227.32
Synonyms:
None
SMILES:
COC1=CC=CC(CSCCN)=C1OC
Tpsa:
44.48
Logp:
1.8957
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
6
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆BrNO₂S
Molecular Weight: 236.09
Synonyms: None
SMILES: COC1=C(Br)SC=C1C(N)=O
Tpsa: 52.32
Logp: 1.6181
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:
C₆H₆BrNO₂S
Molecular Weight:
236.09
Synonyms:
None
SMILES:
COC1=C(Br)SC=C1C(N)=O
Tpsa:
52.32
Logp:
1.6181
H Acceptors:
3
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: C₇H₅BrClI
Molecular Weight: 331.38
Synonyms: None
SMILES: ClC1=C(I)C=C(CBr)C=C1
Tpsa: 0
Logp: 3.8395
H Acceptors: 0
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:
C₇H₅BrClI
Molecular Weight:
331.38
Synonyms:
None
SMILES:
ClC1=C(I)C=C(CBr)C=C1
Tpsa:
0
Logp:
3.8395
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
1