Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용

HCID 100968생성일: 2026년 11월 4일

칼릭솔

칼릭솔 · CALYXOL · Einecs 261-629-6 · autumn carboxylate · ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-enecarboxylate · ETHYL-2-METHYL-6-PENTYL-4-OXOCYCLOHEX-2-ENE CARBOXYLATE · ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate · Ethyl 2-methyl-6-pentyl-4-oxocyclohex-2-ene-1-carboxylate

https://huagongshe.com/ko/chemical/100968

식별자 및 물리적 특성

CAS No.	59151-19-8
분자식	C15H24O3
평균 분자량	252.35 g/mol
단동위원소 질량	252.17254462 g/mol
SMILES	CCCCCC1CC(=O)C=C(C)C1C(=O)OCC
InChIKey	ZJLHQWGPVWXKME-UHFFFAOYSA-N
PubChem CID	100968
EC No.	261-629-6
DTXSID	DTXSID40866743
현지명	칼릭솔

화학 및 물리적 성질

XLogP	3.3
극성 표면적	43.4
수소 결합 공여자 수	0
수소 결합 수용자 수	3
회전 가능 결합 수	7
무거운 원자 수	18
형식 전하	0
복잡도	331
향료	Fragrance Ingredient (Ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate) -> IFRA transparency List
끓는 점	315℃ at 101.3kPa
증기압	0.005Pa at 20℃
물리적 상태	액체
냄새	100.00%에서. 달콤한 아니스 꽃무늬 깨끗한 가을 재스민
향취 유형	꽃향기
화장품 원료 기능	향수
LogP(분배 계수)	3.3-3.4 at 35℃ and pH7
EPA	2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-6-pentyl-, ethyl ester (59151-19-8)

안전 및 규제

GHS 분류	This chemical does not meet GHS hazard criteria for 15.4% (235 of 1524) of reports.H412 (84.6%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P273, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 1524 reports by companies from 2 notifications to the ECHA C&L Inventory.
규제 정보	Chemical: 2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-6-pentyl-, ethyl esterREACH registered substance: Ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate (EC: 261-629-6)2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-6-pentyl-, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories	Aquatic Chronic 3 (84.6%)
TSCA 등재 상태	TSCA listed

칼릭솔

CAS No.

59151-19-8

분자식

C15H24O3

평균 분자량

252.35 g/mol

단동위원소 질량

252.17254462 g/mol

SMILES

CCCCCC1CC(=O)C=C(C)C1C(=O)OCC

InChIKey

ZJLHQWGPVWXKME-UHFFFAOYSA-N

PubChem CID

100968

EC No.

261-629-6

DTXSID

DTXSID40866743

현지명

칼릭솔

화학 및 물리적 성질

XLogP

3.3

극성 표면적

43.4

수소 결합 공여자 수

수소 결합 수용자 수

회전 가능 결합 수

무거운 원자 수

형식 전하

복잡도

331

향료

Fragrance Ingredient (Ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate) -> IFRA transparency List

끓는 점

315℃ at 101.3kPa

증기압

0.005Pa at 20℃

물리적 상태

액체

냄새

100.00%에서. 달콤한 아니스 꽃무늬 깨끗한 가을 재스민

향취 유형

꽃향기

화장품 원료 기능

향수

LogP(분배 계수)

3.3-3.4 at 35℃ and pH7

EPA

2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-6-pentyl-, ethyl ester (59151-19-8)

안전 및 규제

GHS 분류

This chemical does not meet GHS hazard criteria for 15.4% (235 of 1524) of reports.H412 (84.6%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P273, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 1524 reports by companies from 2 notifications to the ECHA C&L Inventory.

규제 정보

Chemical: 2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-6-pentyl-, ethyl esterREACH registered substance: Ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate (EC: 261-629-6)2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-6-pentyl-, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and Categories

Aquatic Chronic 3 (84.6%)

TSCA 등재 상태

TSCA listed