기본 정보
- 표준 SMILES
O=C(O)C1CC2CCC1C2- InChIKey
JESWDXIHOJGWBP-UHFFFAOYSA-N- 분자식
- C8H12O2
- 평균 분자량
- 140.18 g/mol
- 단동위원소 질량
- 140.08372962
개요
See other relationships...
이름 및 식별자
- 우선 이름
- Bicyclo[2.2.1]heptane-2-carboxylic acid
- IUPAC
- bicyclo[2.2.1]heptane-2-carboxylic acid
- 현지명
- BICYCLO[2.2.1]헵탄-2-카르복실산
- 영어명
- BICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID
- 분자식
- C8H12O2
- 분자량
- 140.18
이름 및 동의어
bicyclo[2.2.1]heptane-2-carboxylic acid824-62-4Bicyclo(2.2.1)heptane-2-carboxylic acidEINECS 212-532-2endo-Bicyclo(2.2.1)heptane-2-carboxylic acidRefChem:568156212-532-2621-576-52-Norbornanecarboxylic acidNorbornane-2-carboxylic acid2-Norbornanecarboxylic acid, endo-MFCD00167749
이름 더 보기
BICYCLO[2.2.1]헵탄-2-카르복실산TIMTEC-BB SBB008208Bicyclo(2.2.1) Heptane-2-BarboxyBicyclo2.2.1üheptane-2-carboxylic acidnorbornane-2-carboxylic acid - [N87486]BICYCLO(2.2.1) HEPTANE-2-BARBOXYLIC ACIDBicyclo[2.2.1]heptane-2-carboxylicacid98%
Bicyclo(2.2.1)heptane-2-carboxylic acid, endo-Bicyclo[2.2.1]heptane-2-carboxylic acid, endo-AKOS016874856CS-W016458AB86378Z147433488934-28-1(1R,2R,4S)-bicyclo[2.2.1]heptane-2-carboxylic acid
데이터베이스 식별자
- CAS
824-62-4、934-28-1- PubChem CID
- 79113
- DTXSID
DTXSID90901315- EC Number
- 212-532-2、621-576-5
- Nikkaji
- J195.079G
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 37.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 165
물리화학적 성질
- 녹는점
- 40 °C · 40°C
- 끓는 점
- 134 · 134-136°C 16mm
- 밀도
- 1.193 · 1.193±0.06 g/cm3(Predicted)
- 굴절률
- 1.4855 · 1.4855
- 인화점
- 100 °C · >100°C
- 저장 조건
- Sealed in dry,Room Temperature
- 물리적 상태
- 크리스탈
- 산도 계수 (pKa)
- 4.83 · 4.83±0.20(Predicted)
- 색상
- 하얀색
- 수용성
- 물에 불용성.
- BRN
- 2042631 · 2042631
- NIST
- Bicyclo(2.2.1)heptane-2-carboxylic acid(824-62-4)
안전 및 규제
GHS 분류
GHS Classification
Danger
H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Danger
H314 (83.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
유해성 정보
Hazard Classes and Categories
Skin Corr. 1B (83.3%)
Eye Dam. 1 (100%)
안전 데이터
- ridadr
- UN3261
- HS 번호
- 2916200090
- risk_code
- 36/38
- hazard_code
- Xi
- safety_code
- 26-36
- 위험 등급
- 8
- 위험 참고 사항
- Irritant
화학 및 산업
응용 분야
용도Norbornane-2-carboxylic acid is used in the preparation of 2-Bromonorbornane-1-carboxylic acid. It is also used as Pharmaceutical intermediates.
공급사50 곳
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