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Pimenta leaf oil | CAS No. 8006-77-7

Pimenta leaf oil

Basic Information

Chemical_Structure_Of

CAS Number

8006-77-7

Molecular Formula

C34H29ClN6O3

Molecular Weight

605.09 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

16.5 deg C

Boiling Point

250-258 °C

Density

1.044 g/mL at 25 °C

Refractive Index

n20/D 1.5335(lit.)

SMILES

ClC1C=CC=CC=1[C@@H]1C(C(NC2C=CC=CN=2)=O)=C(C)NC(C2C=CC(=CC=2)N2C(C)=NC3C=NC=CC2=3)=C1C(=O)OCC

InChI

1S/C34H29ClN6O3/c1-4-44-34(43)31-30(24-9-5-6-10-25(24)35)29(33(42)40-28-11-7-8-17-37-28)20(2)38-32(31)22-12-14-23(15-13-22)41-21(3)39-26-19-36-18-16-27(26)41/h5-19,30,38H,4H2,1-3H3,(H,37,40,42)/t30-/m1/s1

InChIKey

ODRYSCQFUGFOSU-SSEXGKCCSA-N

LogP

6.351220000000006

Topological Polar Surface Area

111.03000000000002 Å²

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

1120

Safety Information

View Safety Information

GHS Hazard Pictograms

H315

H315

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

Synonyms & References

English

Pimenta Oil
PIMENTA BERRY OIL
PIMENTO LEAF OIL
PIMENTO OIL
PIMENTO OIL, BERRY
OIL OF GERANIUM
ALLSPICE OIL
ALLSPICE OLEORESIN
GERANIUM OIL, CHINESE TYPE
Pimento Berry Oil
PIMENTA
PiMenta leaf oil
Modipafant
1DMI0E5023
(R)-ethyl 4-(2-chlorophenyl)-6-methyl-2-(4-(2-methyl-1H-imidazo[4,5-c]pyridin-1-yl)phenyl)-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate
Modipafant [INN:BAN]
UK 80067
ethyl (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate
Q27252294

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

1,3-Dibromo-2,4-dichloro-5-fluorobenzene

CAS Number: 1000573-45-4

Molecular Formula: C6HFCl2Br2

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine

CAS Number: 103687-96-3

Molecular Formula: C17H19NO5S

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine

CAS Number: 112897-99-1

Molecular Formula: C30H31N3O7

Darunavir-d9 structure

Darunavir-d9

CAS Number: 1133378-37-6

Molecular Formula: C27H28D9N3O7S

2-Bromo-3-isopropoxypyridine structure

2-Bromo-3-isopropoxypyridine

CAS Number: 113503-65-4

Molecular Formula: C8H10BrNO

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate structure

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate

CAS Number: 116543-91-0

Molecular Formula: C11H7FO4

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile

CAS Number: 121055-10-5

Molecular Formula: C17H17NO4

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate

CAS Number: 1263059-26-2

Molecular Formula: C8H6ClN3O2

8-Bromoisoquinolin-1-amine structure

8-Bromoisoquinolin-1-amine

CAS Number: 1337879-85-2

Molecular Formula: C9H7BrN2

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Supplier Information

MU-INTEL

CAS Number: 8006-77-7

JiangXiBaoLinTianRanXiangLiao Co Ltd

CAS Number: 8006-77-7

AnNaiJiHuaXue (Energy Chemical)

CAS Number: 8006-77-7

Guangzhou Taigu Ren Trade Co., Ltd.

CAS Number: 8006-77-7

Lebermuth

CAS Number: 8006-77-7