기본 정보
- 표준 SMILES
CC(C)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O- InChIKey
UGNIYGNGCNXHTR-UHFFFAOYSA-N- 분자식
- C20H21NO4
- 평균 분자량
- 339.4 g/mol
- 단동위원소 질량
- 339.14705815
이름 및 식별자
- 우선 이름
- N-((9H-fluoren-9-ylmethoxy)carbonyl)-L-valine
- IUPAC
- 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoic acid
- 영어명
- N-FMOC-(L-VALINE-UL-14C)
- 분자식
- C20H21NO4
- 분자량
- 349.48
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
126727-02-4、140663-39-4、68858-20-8、84624-17-9- PubChem CID
- 100115
- UNII
- BXE5G978FA
- EC Number
- 272-515-0、994-896-9
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 75.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 470
실험 및 물리화학적 성질
물리화학적 성질
- 저장 조건
- 20 °C · −20°C
- 물리적 상태
- 에탄올 용액에 용해됨
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (5 of 10) of reports.
Warning
H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (20%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (30%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (30%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (20%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (30%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 10 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 5 of 10 reports by companies.;There are 3 notifications provided by 5 of 10 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Hazard Classes and Categories
Skin Irrit. 2 (30%);Eye Irrit. 2A (30%);STOT SE 3 (30%)
Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)
안전 데이터
- wgk
- 3
- ridadr
- UN 2910 7
- hazard_code
- R
화학 및 산업
용도 및 제조
공급사19 곳
관련 반응
연결된 노트
불러오는 중…