Ylang

CAS Number: 8006-81-3

Molecular Formula: C15H24

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About Ylang

Ylang-Ylang Oil (CAS 8006-81-3) is increasingly utilized within the United States API intermediates market as a bioactive botanical precursor for advanced dermatological formulations, where domestic CDMOs prioritize sourcing high purity fine chemicals to ensure compliance with rigorous USP monographic standards. Canang...

Ylang Specifications

CAS Number

8006-81-3

Molecular Formula

C15H24

IUPAC Name

4-methylsulfonyl-2-nitrobenzoic acid

Canonical SMILES

CC1=CC[C@@H]2[C@@H]3[C@H]1[C@]2(CC[C@H]3C(C)C)C

InChI

InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12+,13+,14-,15-/m0/s1

EINECS Number

281-092-1

MDL Number

MFCD00217954

HSN No

33019090

CAS Number

8006-81-3

Molecular Formula

C15H24

IUPAC Name

4-methylsulfonyl-2-nitrobenzoic acid

Canonical SMILES

CC1=CC[C@@H]2[C@@H]3[C@H]1[C@]2(CC[C@H]3C(C)C)C

InChI

InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12+,13+,14-,15-/m0/s1

EINECS Number

281-092-1

MDL Number

MFCD00217954

HSN No

33019090

Boiling Point

261°C to 264°C

Freezing point

Not determined

Flash Point

93.33 °C

Density

0.93 - 0.95 g/cm3

Precise Quality

8006-81-3

PSA

0 Å²

logP

1.8

Average mass

154.25 g/mol

Monoisotopic mass

204.187800766 Da

Molar mass

204.35 g/mol

Vapour pressure

0.11 mmHg at 25 °C

Precautionary Statement Codes

P261, P272, P280, P302+P352, P333+P313, P321, P363, P501, P273, P501, P264, P280, P302+P352, P321, P332+P313, and P362

Hazard Classes and Categories

Skin Sens. 1 Skin Irrit. 2

Aromatherapy Agent

A natural essential oil extracted from Cananga odorata flowers used to reduce stress, anxiety, and blood pressure while promoting emotional well-being