2-METHYL-2-헥센산

2-Hexenoic acid, 2-methyl-

HCID 5282650
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기본 정보

CAS
28897-58-7
표준 SMILES
CCC/C=C(\C)C(=O)O
InChIKey
AKOVMBAFZSPEQU-AATRIKPKSA-N
분자식
C7H12O2
평균 분자량
128.17 g/mol

개요

2-methyl-2E-hexenoic acid is a medium-chain fatty acid.

이름 및 식별자

우선 이름
2-Hexenoic acid, 2-methyl-
IUPAC
(E)-2-methylhex-2-enoic acid
현지명
2-METHYL-2-헥센산
영어명
2-Methyl-2-hexenoic acid
분자식
C7H12O2
분자량
128.17

이름 및 동의어

2-Methyl-2-hexenoic acid28897-58-72-Hexenoic acid, 2-methyl-EINECS 249-294-4DTXSID0067422RefChem:472887DTXCID2037891(E)-2-methylhex-2-enoic acid(E)-2-methyl-2-hexenoic acid2-methyl-2E-hexenoic acid(2E)-2-Methylhex-2-Enoic Acid97961-66-5
이름 더 보기
2-METHYL-2-헥센산2-Methyl-2-hexenoicRARECHEM AL BM 01622-methyl-2-hexenoicaci2-methylhex-2-enoic acid2-Methyl-2-hexenoicAcid>2-Hexenoic acid, 2-methyl-
2-Hexenoic acid, 2-methyl-, (2E)-MFCD00015855(2E)-2-Methyl-2-hexenoic acidEZM6AC2ZNF2-Methylhex-2-enoicacidSCHEMBL23310SCHEMBL6722403trans-2-methyl-hex-2-enoic acid

데이터베이스 식별자

CAS
28897-58-7、97961-66-5
PubChem CID
5282650
ChEBI
CHEBI:179470
UNII
EZM6AC2ZNF
EC Number
249-294-4
Nikkaji
J286.475D、J764.838C

물성

구조 계산 물성

XLogP
2
극성 표면적
37.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
9

실험 및 물리화학적 성질

LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Branched fatty acids [FA0102]
SpringerMaterials PropertiesOptical coefficient

물리화학적 성질

녹는점
-9.25 °C · -9.25°C (estimate)
끓는 점
89 °C · 89 °C / 1mmHg
밀도
0.97 · 0.97
굴절률
1.4273 · 1.4273 (estimate)
인화점
86 °C · 86°C
용해도
DMSO(약간 용해됨), 메탄올(약간 용해됨)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H290 (96.7%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 30 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: 2-Hexenoic acid, 2-methyl-

2-Hexenoic acid, 2-methyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesMet. Corr. 1 (96.7%)

안전 데이터

tsca
TSCA listed
ridadr
3265
HS 번호
2916199590
risk_code
34-36
hazard_code
Xi
safety_code
26-27-36/37/39

화학 및 산업

용도 및 제조

General Manufacturing Information2-Hexenoic acid, 2-methyl-: ACTIVE

공급사25 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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