CS-0380013
tert-Butyl-(3-(hydroxymethylene)-4-oxocyclohexyl)carbamate
Manufacturer: ChemScene
CAS Number: 911485-70-6
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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
C₁₂H₁₉NO₄
Molecular Weight
241.28
Synonyms
Carbamic acid, N-[3-(hydroxymethylene)-4-oxocyclohexyl]-, 1,1-dimethylethyl ester
SMILES
O=C(OC(C)(C)C)NC1C/C(C(CC1)=O)=C/O
Tpsa
75.63
Logp
2.0746
H Acceptors
4
H Donors
2
Rotatable Bonds
1
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: C₁₂H₁₉NO₄
Molecular Weight: 241.28
Synonyms: Carbamic acid, N-[3-(hydroxymethylene)-4-oxocyclohexyl]-, 1,1-dimethylethyl ester
SMILES: O=C(OC(C)(C)C)NC1C/C(C(CC1)=O)=C/O
Tpsa: 75.63
Logp: 2.0746
H Acceptors: 4
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:
C₁₂H₁₉NO₄
Molecular Weight:
241.28
Synonyms:
Carbamic acid, N-[3-(hydroxymethylene)-4-oxocyclohexyl]-, 1,1-dimethylethyl ester
SMILES:
O=C(OC(C)(C)C)NC1C/C(C(CC1)=O)=C/O
Tpsa:
75.63
Logp:
2.0746
H Acceptors:
4
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: C₁₂H₁₈N₂O₃
Molecular Weight: 238.28
Synonyms: None
SMILES: O=C(OC(C)(C)C)NC1CC2=C(ON=C2)CC1
Tpsa: 64.36
Logp: 2.0566
H Acceptors: 4
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:
C₁₂H₁₈N₂O₃
Molecular Weight:
238.28
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NC1CC2=C(ON=C2)CC1
Tpsa:
64.36
Logp:
2.0566
H Acceptors:
4
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: C₁₅H₁₈N₂O₃
Molecular Weight: 274.32
Synonyms: 1-Piperidinecarboxylic acid, 4-(cyanomethyl)-4-hydroxy-, phenylmethyl ester
SMILES: O=C(N1CCC(O)(CC#N)CC1)OCC2=CC=CC=C2
Tpsa: 73.56
Logp: 2.06378
H Acceptors: 4
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:
C₁₅H₁₈N₂O₃
Molecular Weight:
274.32
Synonyms:
1-Piperidinecarboxylic acid, 4-(cyanomethyl)-4-hydroxy-, phenylmethyl ester
SMILES:
O=C(N1CCC(O)(CC#N)CC1)OCC2=CC=CC=C2
Tpsa:
73.56
Logp:
2.06378
H Acceptors:
4
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: C₁₅H₂₂N₂O₃
Molecular Weight: 278.35
Synonyms: 1-Piperidinecarboxylic acid, 4-(2-aminoethyl)-4-hydroxy-, phenylmethyl ester
SMILES: O=C(N1CCC(O)(CCN)CC1)OCC2=CC=CC=C2
Tpsa: 75.79
Logp: 1.4989
H Acceptors: 4
H Donors: 2
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:
C₁₅H₂₂N₂O₃
Molecular Weight:
278.35
Synonyms:
1-Piperidinecarboxylic acid, 4-(2-aminoethyl)-4-hydroxy-, phenylmethyl ester
SMILES:
O=C(N1CCC(O)(CCN)CC1)OCC2=CC=CC=C2
Tpsa:
75.79
Logp:
1.4989
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4