CS-0646709
3-Cyano-4-propylbenzoic acid
Manufacturer: ChemScene
CAS Number: 2750620-47-2
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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
C₁₁H₁₁NO₂
Molecular Weight
189.21
Synonyms
None
SMILES
O=C(O)C1=CC=C(CCC)C(C#N)=C1
Tpsa
61.09
Logp
2.20898
H Acceptors
2
H Donors
1
Rotatable Bonds
3
Related Products
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: C₁₁H₁₁NO₂
Molecular Weight: 189.21
Synonyms: None
SMILES: O=C(O)C1=CC=C(CCC)C(C#N)=C1
Tpsa: 61.09
Logp: 2.20898
H Acceptors: 2
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:
C₁₁H₁₁NO₂
Molecular Weight:
189.21
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(CCC)C(C#N)=C1
Tpsa:
61.09
Logp:
2.20898
H Acceptors:
2
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: C₅H₇NO
Molecular Weight: 97.12
Synonyms: None
SMILES: N#C[C@H]1[C@H](CO)C1
Tpsa: 44.02
Logp: 0.13838
H Acceptors: 2
H Donors: 1
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:
C₅H₇NO
Molecular Weight:
97.12
Synonyms:
None
SMILES:
N#C[C@H]1[C@H](CO)C1
Tpsa:
44.02
Logp:
0.13838
H Acceptors:
2
H Donors:
1
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: C₄H₁₁ClN₂O₂S
Molecular Weight: 186.66
Synonyms: None
SMILES: NS(=O)([C@@H]1CCNC1)=O.Cl
Tpsa: 72.19
Logp: -0.9414
H Acceptors: 3
H Donors: 2
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:
C₄H₁₁ClN₂O₂S
Molecular Weight:
186.66
Synonyms:
None
SMILES:
NS(=O)([C@@H]1CCNC1)=O.Cl
Tpsa:
72.19
Logp:
-0.9414
H Acceptors:
3
H Donors:
2
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: C₇H₁₁F₃O₂
Molecular Weight: 184.16
Synonyms: None
SMILES: OCC1(C(F)(F)F)CCOCC1
Tpsa: 29.46
Logp: 1.3378
H Acceptors: 2
H Donors: 1
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:
C₇H₁₁F₃O₂
Molecular Weight:
184.16
Synonyms:
None
SMILES:
OCC1(C(F)(F)F)CCOCC1
Tpsa:
29.46
Logp:
1.3378
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1