CS-0654112
(1r,4r)-4-(Methoxycarbonyl)cyclohexanecarboxylic acid
Manufacturer: ChemScene
CAS Number: None
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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
C₉H₁₄O₄
Molecular Weight
186.21
Synonyms
None
SMILES
O=C(O)[C@H]1CC[C@H](C(OC)=O)CC1
Tpsa
63.6
Logp
1.0504
H Acceptors
3
H Donors
1
Rotatable Bonds
2
Other Options
...
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₉H₁₄O₄
Molecular Weight: 186.21
Synonyms: None
SMILES: O=C(O)[C@H]1CC[C@H](C(OC)=O)CC1
Tpsa: 63.6
Logp: 1.0504
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:
C₉H₁₄O₄
Molecular Weight:
186.21
Synonyms:
None
SMILES:
O=C(O)[C@H]1CC[C@H](C(OC)=O)CC1
Tpsa:
63.6
Logp:
1.0504
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: C₂₀H₂₄ClN₅
Molecular Weight: 369.89
Synonyms: None
SMILES: C[C@H]1[C@@H](N(C2=NC(Cl)=NC3=C2C=CN3)C)CN(CC4=CC=CC=C4)CC1
Tpsa: 48.05
Logp: 3.9581
H Acceptors: 4
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:
C₂₀H₂₄ClN₅
Molecular Weight:
369.89
Synonyms:
None
SMILES:
C[C@H]1[C@@H](N(C2=NC(Cl)=NC3=C2C=CN3)C)CN(CC4=CC=CC=C4)CC1
Tpsa:
48.05
Logp:
3.9581
H Acceptors:
4
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: C₂₅H₃₄O₃
Molecular Weight: 382.54
Synonyms: None
SMILES: C[C@@]12[C@](CC[C@@H]2[C@H](/C=C/[C@H](O)C3CC3)C)([H])[C@@H](OC(C4=CC=CC=C4)=O)CCC1
Tpsa: 46.53
Logp: 5.3916
H Acceptors: 3
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:
C₂₅H₃₄O₃
Molecular Weight:
382.54
Synonyms:
None
SMILES:
C[C@@]12[C@](CC[C@@H]2[C@H](/C=C/[C@H](O)C3CC3)C)([H])[C@@H](OC(C4=CC=CC=C4)=O)CCC1
Tpsa:
46.53
Logp:
5.3916
H Acceptors:
3
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: C₆H₂Cl₂IN₃
Molecular Weight: 313.91
Synonyms: None
SMILES: ClC1=C2C(I)=CN=C2NC(Cl)=N1
Tpsa: 41.57
Logp: 2.8209
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₂Cl₂IN₃
Molecular Weight:
313.91
Synonyms:
None
SMILES:
ClC1=C2C(I)=CN=C2NC(Cl)=N1
Tpsa:
41.57
Logp:
2.8209
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0