기본 정보
- CAS
1217859-41-0- 표준 SMILES
CC(C)(C)OC(=O)N1C[C@@H](C(=O)O)[C@H](c2cccc(Cl)c2)C1- InChIKey
JWDQWZPPUIYEEZ-QWHCGFSZSA-N- 분자식
- C16H20ClNO4
- 평균 분자량
- 325.79 g/mol
이름 및 식별자
- 우선 이름
- Trans-1-Boc-4-(3-chlorophenyl)pyrrolidine-3-carboxylic acid
- IUPAC
- (3S,4R)-4-(3-chlorophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
- 현지명
- BOC-(TRANS)-4-(3-CHLORO-페닐)-피롤리딘-3-카르복실산
- 영어명
- Boc-(trans)-4-(3-chloro-phenyl)-pyrrolidine-3-carboxylic acid
- 분자식
- C16H20ClNO4
- 분자량
- 325.79
이름 및 동의어
Trans-1-Boc-4-(3-chlorophenyl)pyrrolidine-3-carboxylic acidBOC-(+/-)-TRANS-4-(3-CHLORO-PHENYL)-PYRROLIDINE-3-CARBOXYLIC ACID1217859-41-0MFCD06659262SCHEMBL16780016JWDQWZPPUIYEEZ-QWHCGFSZSA-NAKOS037655586(3S,4R)-4-(3-chlorophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acidPS-12691CS-0158455(3S,4R)-1-tert-butoxycarbonyl-4-(3-chlorophenyl)pyrrolidine-3-carboxylic acid(trans)-1-(tert-Butoxycarbonyl)-4-(3-chlorophenyl)pyrrolidine-3-carboxylic acid
이름 더 보기
BOC-(TRANS)-4-(3-CHLORO-페닐)-피롤리딘-3-카르복실산BOC-TRANS-DL-PRO(3-CHLOROPHENYL)-OHBoc-trans-DL-b-Pro-4-(3-chlorophenyl)-OHBOC-±-TRANS-4-3-CHLORO-PHENYL-PYRROLIDINE-3-CARBOXYLICACIDBoc-(trans)-4-(3-chloro-phenyl)-pyrrolidine-3-carboxylic acid(±)-trans-1-Boc-4-(3-chloro-phenyl)-pyrrolidine-3-carboxylic acidtrans-1-tert-Butoxycarbonyl-4-(3-chlorophenyl)pyrrolidine-3-carboxylic acid(±)-trans-1-(t-Butoxycarbonyl)-4-(3-chlorophenyl)pyrrolidine-3-carboxylic acid
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 66.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 434
물리화학적 성질
- 끓는 점
- 464.399 · 464.399±45.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.276 · 1.276±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 산도 계수 (pKa)
- 4.26 · 4.260±0.40(predicted)
화학 및 산업
공급사18 곳
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
吉尔生化（玉门）有限公司18221406464 18221406464;13236395639 · [email protected]
无锡亚肽生物科技有限公司0510-83583050 13771062561 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
吉尔多肽生物制药（大连市）有限公司021-61263455 13167021076 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
康化（上海）新药研发有限公司021-61263370 18516560301 · [email protected]
上海吉奉生物科技有限公司021-61263377 15023907684 · [email protected]
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
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