기본 정보
- CAS
20641-28-5- 표준 SMILES
CCOP(=O)(OCC)C(O)c1ccc(Cl)cc1- InChIKey
RIQJHXWKWXDLFM-UHFFFAOYSA-N- 분자식
- C11H16ClO4P
- 평균 분자량
- 278.67 g/mol
- 단동위원소 질량
- 278.0474737
이름 및 식별자
- 우선 이름
- Diethyl P-((4-chlorophenyl)hydroxymethyl)phosphonate
- IUPAC
- (4-chlorophenyl)-diethoxyphosphorylmethanol
- 현지명
- (α-히드록시-4-클로로벤질)포스폰산디에틸에스테르
- 영어명
- (α-Hydroxy-4-chlorobenzyl)phosphonic acid diethyl ester
- 분자식
- C11H16ClO4P
- 분자량
- 278.67
이름 및 동의어
20641-28-5DTXSID001216711Diethyl P-((4-chlorophenyl)hydroxymethyl)phosphonateDiethyl P-[(4-chlorophenyl)hydroxymethyl]phosphonateRefChem:1083508DTXCID801648039Phosphonic acid, ((4-chlorophenyl)hydroxymethyl)-, diethyl ester(4-chlorophenyl)-diethoxyphosphorylmethanoldiethyl [(4-chlorophenyl)(hydroxy)methyl]phosphonateDiethyl ((4-chlorophenyl)(hydroxy)methyl)phosphonateNSC 404325BRN 1984002
이름 더 보기
(α-히드록시-4-클로로벤질)포스폰산디에틸에스테르(α-Hydroxy-4-chlorobenzyl)phosphonic acid diethyl ester(4-Chlorophenyl)hydroxymethylphosphonic acid diethyl ester[(p-Chlorophenyl)hydroxymethyl]phosphonic acid diethyl esterPhosphonic acid, P-[(4-chlorophenyl)hydroxymethyl]-, diethyl ester
AI3-17767alpha-Toluenephosphonic acid, p-chloro-alpha-hydroxy-, diethyl esterp-Chloro-alpha-hydroxy-alpha-toluenephosphonic acid diethyl esterSCHEMBL11140297RIQJHXWKWXDLFM-UHFFFAOYSA-NPhosphonic acid, (p-chloro-alpha-hydroxybenzyl)-, diethyl esterNSC404325STK369667
데이터베이스 식별자
- CAS
20641-28-5- PubChem CID
- 89363
- DTXSID
DTXSID001216711- Nikkaji
- J48.036C
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 55.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 256
화학 및 산업
공급사3 곳
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