네오맨톨

(+)-Neomenthol

HCID 439263CAS 2216-52-6

기본 정보

표준 SMILES
CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1O
InChIKey
NOOLISFMXDJSKH-UTLUCORTSA-N
분자식
C10H20O
평균 분자량
156.26 g/mol

개요

D,l-menthol is a white crystalline solid with a peppermint odor and taste. (NTP, 1992)

이름 및 식별자

우선 이름
(+)-Neomenthol
IUPAC
(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol
현지명
네오맨톨
영어명
(+)-NEOMENTHOL
분자식
C10H20O
분자량
156.27

이름 및 동의어

(+)-Neomenthol2216-52-6d-NeomentholNeomenthol, (+)-(1S,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol42RE7MA7PAMenthol, (1R,3S,4S)-(+)-FEMA No. 2666DTXSID9044326CHEBI:15402(+) Neomenthol
이름 더 보기
네오맨톨(+)-네오멘톨FEMA 2666Einecs 218-691-4(+)-Neomenthol>dextro-neomentholD-NEOMENTHOL 99+%
RefChem:1048979DTXCID7024326218-691-4(1S,2S,5R)-2-Isopropyl-5-methylcyclohexanoldl-Neomenthol3623-51-6NeomentholNeomenthol, D-

데이터베이스 식별자

CAS
2216-52-6、3623-51-6、491-01-0、89-78-1
PubChem CID
439263
DTXSID
DTXSID20883998
ChEMBL
CHEMBL1907991
ChEBI
CHEBI:15402
UNII
42RE7MA7PA、89S3KO7RR9
EC Number
207-723-2、218-691-4、222-824-1
Nikkaji
J215.948A

물성

구조 계산 물성

XLogP
3
극성 표면적
20.2 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
1
무거운 원자 수
11

실험 및 물리화학적 성질

LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
Fragrances · 2건

Fragrance Ingredient ((+)-Neomenthol) -> IFRA transparency List

Fragrance Ingredient (dl-Neomenthol) -> IFRA transparency List

Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density · 3건

0.904 at 59 °F (NTP, 1992) - Less dense than water; will float

0.901 (20 °C); 0.891 (30 °C)

0.896-0.903 (20 °C)

Flavoring AgentsEU Flavoring substances
Solubility · 5건

less than 1 mg/mL at 70 °F (NTP, 1992)

very soluble in alcohol and volatile oils; slightly soluble in water

(in ethanol)

insoluble in water; soluble in alcohol and acetone

(in ethanol)

물리화학적 성질

녹는점
22 °C · −22 °C(lit.)
끓는 점
95 °C12 · 95 °C12 mm Hg(lit.)
밀도
0.899 g/mL · 0.899 g/mL at 25 °C(lit.)
증기압
0.8 mm · 0.8 mm Hg ( 20 °C)
굴절률
20 · n20/D 1.461
FEMA
2666 · 2666 | (+)-NEOISOMENTHOL

화학적 성질

d-Neomenthol has a menthol-like odor. It is used in mixtures of menthols as a substitute for l-menthol.

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 248 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

유해성 정보

Regulatory Information · 6건

Chemical: Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-rel-

Chemical: Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1S-(1.alpha.,2.alpha.,5.beta.)]-

Chemical: Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2R,5S)-rel-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-rel- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-rel- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 11-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22569

Status: Active Update: 29-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/25394

Other Safety Information · 3건

IMAP assessments - Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-rel-: Human health tier I assessment

IMAP assessments - Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1S-(1.alpha.,2.alpha.,5.beta.)]-: Human health tier I assessment

IMAP assessments - Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2R,5S)-rel-: Human health tier I assessment

Fire HazardsThis chemical is combustible. (NTP, 1992)
Health Hazards · 1건

SYMPTOMS: Symptoms of exposure to this compound may include irritation of the skin, eyes, mucous membranes and upper respiratory tract. Exposure may also cause hypersensitivity reactions including contact dermatitis, spasms of the glottis and collapse in young children, urticaria, flushing, headache, insomnia, unsteady gait, thick speech, tremor of the hands, mental confusion, depression, vomiting, cramp in the legs and bradycardia. Exposure to compounds of this class may cause painless blanching or erythema, possible corrosion, profuse sweating, intense thirst, nausea, diarrhea, cyanosis from methemoglobinemia, hyperactivity, stupor, blood pressure fall, hyperpnea, abdominal pain, hemolysis, convulsions, coma and pulmonary edema followed by pneumonia. If death from respiratory failure is not immediate, jaundice and oliguria or anuria may occur. These compounds occasionally cause skin sensitization.

Reactive GroupAlcohols and Polyols
Reactivity Profile · 1건

D,L-MENTHOL is incompatible with butyl chloral hydrate, camphor, phenol, chloral hydrate, Exalgine, betanaphthol, resorcinol or thymol in triturations; potassium permanganate, chromium trioxide and pyrogallol. It is also incompatible with strong oxidizers. (NTP, 1992)

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
OT0450000
HS 번호
2906190090
risk_code
37/38-41
hazard_code
Xi

화학 및 산업

약리 정보

Cellular LocationsExtracellular

용도 및 제조

U.S. Production2023: 1,000,000 - <8,500,000 lb
Consumer UsesFragrance
Industry UsesOdor agents
Household ProductsInformation on 35 consumer products that contain Menthol (Racementhol) in the following categories is provided:
Use Classification · 4건

Fragrance Ingredients

Fragrance Ingredients

Flavoring Agents -> JECFA Flavorings Index

Flavoring Agents -> JECFA Flavorings Index

General Manufacturing Information · 4건

Soap, Cleaning Compound, and Toilet Preparation Manufacturing

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-rel-: ACTIVE

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1S,2S,5R)-: ACTIVE

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2R,5S)-rel-: ACTIVE

응용 분야 · 4건

개요d-Neomenthol has a menthol-like odor. It is used in mixtures of menthols as a substitute for ι-menthol.

출처Reported found in corn mint oil (Mentha arvenis).

용도(+)-Neomenthol is a reagent used in the preparation of alkyl sulfonyl fluorides.

일반 설명(1S,2S,5R)-(+)-Neomenthol is a monoterpenoid compound found in the peppermint herb, Mentha piperita L. This menthol isomer is generally used as an additive in oral hygiene products and as a flavoring agent in food and beverages.

상·하류 제품 정보

하류 제품

공급사9 곳

上海纽雀客生物科技有限公司13916276291 · [email protected]
常州宣叶科技有限公司15195022192 · [email protected]
TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]
常州衍旭科技有限公司18106123700 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]

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