CS-0653443

(1R,3aR,7aR)-Octahydro-1-[(1R,2E,4S)-5-hydroxy-1,4,5-trimethyl-2-hexen-1-yl]-7a-methyl-4H-inden-4-one

Manufacturer: ChemScene

CAS Number: 95716-68-0

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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

C₁₉H₃₂O₂

Molecular Weight

292.46

Synonyms

None

SMILES

C[C@@]12[C@@](CC[C@@]1([H])C(CCC2)=O)([H])[C@H](C)/C=C/[C@H](C)C(C)(O)C

Tpsa

37.3

Logp

4.3712

H Acceptors

2

H Donors

1

Rotatable Bonds

4

SAFETY INFORMATION

ghsPictogramUrl

https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

Precautionary Statements

P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Img

ChemScene

CS-0653443

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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:
C₁₉H₃₂O₂

Molecular Weight:
292.46

Synonyms:
None

SMILES:
C[C@@]12[C@@](CC[C@@]1([H])C(CCC2)=O)([H])[C@H](C)/C=C/[C@H](C)C(C)(O)C

Tpsa:
37.3

Logp:
4.3712

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
4

Img

ChemScene

CS-0653444

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₁H₁₉NO₄

Molecular Weight:
229.27

Synonyms:
None

SMILES:
O=C(OCC)C(C#N)CC(OCC)OCC

Tpsa:
68.55

Logp:
1.47848

H Acceptors:
5

H Donors:
0

Rotatable Bonds:
8

Img

ChemScene

CS-0653446

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₂₃H₂₃O₂P

Molecular Weight:
362.40

Synonyms:
(Carbethoxyethylidene)triphenylphosphorane

SMILES:
CC(C(OCC)=O)=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Tpsa:
26.3

Logp:
3.7359

H Acceptors:
2

H Donors:
0

Rotatable Bonds:
5

Img

ChemScene

CS-0653447

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₀H₁₅F₂NO

Molecular Weight:
203.23

Synonyms:
None

SMILES:
OC[C@@]12C[C@@]3(CC3(F)F)CN1CCC2

Tpsa:
23.47

Logp:
1.2424

H Acceptors:
2

H Donors:
1

Rotatable Bonds:
1