알파-헥실-감마-부티로락톤

alpha-Hexyl-gamma-butyrolactone

HCID 86736CAS 18436-37-8

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCCCCCC1CCOC1=O
InChIKey: IBVDLVUXSDSVQF-UHFFFAOYSA-N
분자식: C10H18O2
평균 분자량: 170.25 g/mol
단동위원소 질량: 170.13067982

이름 및 식별자

우선 이름: alpha-Hexyl-gamma-butyrolactone
IUPAC: 3-hexyloxolan-2-one
현지명: 알파-헥실-감마-부티로락톤
영어명: ALPHA-HEXYL-GAMMA-BUTYROLACTONE
분자식: C10H18O2
분자량: 170.25

이름 및 동의어

alpha-Hexyl-gamma-butyrolactone18436-37-83-Hexyldihydrofuran-2(3H)-onealpha-Decalactone2(3H)-Furanone, 3-hexyldihydro-3-Hexyldihydro-2(3H)-furanoneDTXSID70474374J0O5KWX81EINECS 242-316-3DTXCID5027437.ALPHA.-HEXYL-.GAMMA.-BUTYROLACTONEOCTANOIC ACID, 2-(2-HYDROXYETHYL)-, .GAMMA.-LACTONE

이름 더 보기

알파-헥실-감마-부티로락톤A-HEXYL-G-BUTYROLACTONE3-hexyldihydro-2(3h)-furanon3-Hexyl-4,5-dihydrofuran-2(3H)-one3-Hexyl-3,4-dihydro-2(5H)-furanone

RefChem:555733ALPHA-HEXYL-GAMMA-BUTYROLACTONE, (+-)-.ALPHA.-HEXYL-.GAMMA.-BUTYROLACTONE, (+-)-OCTANOIC ACID, 2-(2-HYDROXYETHYL)-, GAMMA-LACTONE264-169-43-hexyloxolan-2-one3-hexyltetrahydrofuran-2-onea-hexylbutyrolactone

데이터베이스 식별자

CAS: 18436-37-8
PubChem CID: 86736
DTXSID: DTXSID7047437
ChEMBL: CHEMBL478639
UNII: 4J0O5KWX81
EC Number: 242-316-3
Nikkaji: J266.175F

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 5
무거운 원자 수: 12
형식 전하: 0
복잡도: 143

실험 및 물리화학적 성질

FragrancesFragrance Ingredient (3-Hexyldihydrofuran-2(3H)-one) -> IFRA transparency List

물리화학적 성질

끓는 점: 146 °C · 146 °C / 16mmHg
밀도: 0 · 0,96 g/cm3
냄새: 100 %에서 · 100.00%에서. 꽃의 달콤한 풀이 무성한 과일 녹색 코코넛
냄새 유형: 녹색
화장품 원료 기능: 향수
LogP: 2.451 · 2.451 (est)
EPA: 2 · 2(3H)-Furanone, 3-hexyldihydro- (18436-37-8)

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 70.3% (90 of 128) of all reports.

Warning

H319 (29.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 128 reports by companies from 2 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 2건

Chemical: 2(3H)-Furanone, 3-hexyldihydro-

2(3H)-Furanone, 3-hexyldihydro-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 2(3H)-Furanone, 3-hexyldihydro-: Human health tier I assessment

Hazard Classes and CategoriesEye Irrit. 2 (29.7%)

안전 데이터

tsca: TSCA listed
HS 번호: 2932190090
risk_code: 20/21/22-36/37/38-36
hazard_code: Xi
safety_code: 26-36/37/39

화학 및 산업

용도 및 제조

Use ClassificationFragrance Ingredients

General Manufacturing Information2(3H)-Furanone, 3-hexyldihydro-: ACTIVE

응용 분야 · 1건

용도Alpha-hexyl-gamma-butyrolactone has been suggested for usc in perfume compositions as a modifier for the more conventional lactoncs. It produces interesting variations in the fruity background notes of heavy Ambrc-like perfumes, and it does not produce the overly sweet or heavy - fruity notes often derived from Undccanolitlc.

상·하류 제품 정보

상류 원료

공급사14 곳

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]

연결된 노트

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