홈MCP워크벤치Skills
홈워크벤치알림마이페이지
Huagongshe 오픈 프로젝트:[email protected]AI 접속: llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.7.8
  1. 홈
  2. /화합물

티몰프탈레인모노포스페이트2-아미노-2-메틸-1,3-프로판디올염

1(3H)-Isobenzofuranone, 3-[4-hydroxy-2-methyl-5-(1-methylethyl)phenyl]-3-[2-methyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-, compd. with 2-amino-2-methyl-1,3-propanediol (1:1)

HCID 103617
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
52279-66-0
표준 SMILES
CC(N)(CO)CO.Cc1cc(O)c(C(C)C)cc1C1(c2cc(C(C)C)c(OP(=O)(O)O)cc2C)OC(=O)c2ccccc21
InChIKey
DIYBCCDKXAYQHV-UHFFFAOYSA-N
분자식
C32H42NO9P
평균 분자량
615.6 g/mol
단동위원소 질량
615.25971891

이름 및 식별자

우선 이름
1(3H)-Isobenzofuranone, 3-[4-hydroxy-2-methyl-5-(1-methylethyl)phenyl]-3-[2-methyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-, compd. with 2-amino-2-methyl-1,3-propanediol (1:1)
IUPAC
2-amino-2-methylpropane-1,3-diol;[4-[1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] dihydrogen phosphate
현지명
티몰프탈레인모노포스페이트2-아미노-2-메틸-1,3-프로판디올염
영어명
Thymolphthalein monophosphate 2-amino-2-methyl-1,3-propanediol salt
분자식
C36H53N2O11P
분자량
720.79

이름 및 동의어

52279-66-0EINECS 257-812-5DTXSID60885996(3-(4-Hydroxy-5-isopropyl-o-tolyl)-1-oxo-3H-isobenzofuran-3-yl)-6-isopropyl-m-tolylphosphoric acid, compound with 2-amino-2-methylpropane-1,3-diol (1:1)RefChem:70708DTXCID501025347Thymolphthalein monophosphate 2-amino-2-methyl-1,3-propanediol salt2-amino-2-methylpropane-1,3-diol;[4-[1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] dihydrogen phosphateThymolphthalein monophosphate2-amino-2-methyl-1,3-propanediolsalt4-{1-[4-Hydroxy-2-methyl-5-(propan-2-yl)phenyl]-3-oxo-1,3-dihydro-2-benzofuran-1-yl}-5-methyl-2-(propan-2-yl)phenyl dihydrogen phosphate--2-amino-2-methylpropane-1,3-diol (1/1)티몰프탈레인모노포스페이트2-아미노-2-메틸-1,3-프로판디올염TMP, AEPD SALT
이름 더 보기
3-propanediol(1:1)thymolphthalein monophosphate 2-amino-*2-methyl-1THYMOLPHTHALEIN MONOPHOSPHATE 2-AMINO-*2 -METHYL-1-3thymolphthaleinmonophosphate2-amino-2-methyl-1,3-propanediolsalt90-THYMOLPHTHALEIN MONOPHOSPHORIC ACID, 2-AMINO-2-ETHYL-1,3-PROPANEDIOL SALThyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-,compd.with2-amino-2-methyl-1,3-(4-hydroxy-5-isopropyl-o-tolyl)-1-oxo-3H-isobenzofuran-3-yl]-6-isopropyl-m-tolylphosphoric acid, compound with 2-amino-2-methylpropane-1,3-diol (1:1)

데이터베이스 식별자

CAS
52279-66-0
PubChem CID
103617
DTXSID
DTXSID60885996
EC Number
257-812-5

물성

구조 계산 물성

극성 표면적
180 Ų
수소 결합 공여자 수
6
수소 결합 수용자 수
10
회전 가능 결합 수
8
무거운 원자 수
43
형식 전하
0
복잡도
891

물리화학적 성질

저장 조건
20 °C · −20°C
EPA
1 · 1(3H)-Isobenzofuranone, 3-[4-hydroxy-2-methyl-5-(1-methylethyl)phenyl]-3-[2-methyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-, compd. with 2-amino-2-methyl-1,3-propanediol (1:1) (52279-66-0)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

안전 데이터

wgk
3
tsca
TSCA listed

화학 및 산업

용도 및 제조

General Manufacturing Information1(3H)-Isobenzofuranone, 3-[4-hydroxy-2-methyl-5-(1-methylethyl)phenyl]-3-[2-methyl-5-(1-methylethyl)-4-(phosphonooxy)phenyl]-, compd. with 2-amino-2-methyl-1,3-propanediol (1:1): INACTIVE

공급사2 곳

北京华美互利生物化工010-56205725 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]

관련 반응

0건
반응 기록 만들기

현재 필터 조건에 해당하는 반응 기록이 없습니다.

화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트